N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxidanylidene-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-2-chloranyl-N-dodecyl-benzamide

Systemtic Name: N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxidanylidene-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-2-chloranyl-N-dodecyl-benzamide Openeye Name: N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-2-chloro-N-dodecyl-benzamide CAS Name: N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-2-chloro-N-dodecylbenzamide IUPAC Name: N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-6,9a,11a-trimethyl-7-oxo-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-2-chloro-N-dodecylbenzamide Traditional Name: N-[(1S,3aS,3bR,5aR,9aR,9bS,11aS)-7-keto-6,9a,11a-trimethyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-1-yl]-2-chloro-N-lauryl-benzamide Formula: C38H59ClN2O2 MolecularWeight: 611.34026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C1CCC2C1(CCC3C2CCC4C3(CCC(=O)N4C)C)C)C(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CCCCCCCCCCCCN([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=O)N4C)C)C)C(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C38H59ClN2O2/c1-5-6-7-8-9-10-11-12-13-16-27-41(36(43)29-17-14-15-18-32(29)39)34-22-20-30-28-19-21-33-37(2,26-24-35(42)40(33)4)31(28)23-25-38(30,34)3/h14-15,17-18,28,30-31,33-34H,5-13,16,19-27H2,1-4H3/t28-,30-,31-,33+,34-,37+,38-/m0/s1