[(2R)-1-oxidanylidene-1-phenyl-butan-2-yl] 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenyl-butan-2-yl] 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylate Openeye Name: [(1R)-1-benzoylpropyl] 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylate CAS Name: 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylic acid [(2R)-1-oxo-1-phenylbutan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-phenylbutan-2-yl] 6,7,11,12b-tetrahydroacenaphthyleno[1,2-b]quinoxaline-9-carboxylate Traditional Name: 6,7,11,12b-tetrahydroacenaphtho[1,2-b]quinoxaline-9-carboxylic acid [(1R)-1-benzoylpropyl] ester Formula: C29H24N2O3 MolecularWeight: 448.51246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CCC3=NC4=C(C5=C6C4C=CC=C6C=CC5)NC3=C2

Isomeric SMILES

CC[C@H](C(=O)C1=CC=CC=C1)OC(=O)C2=CCC3=NC4=C(C5=C6C4C=CC=C6C=CC5)NC3=C2

InChI

InChI=1S/C29H24N2O3/c1-2-24(28(32)18-8-4-3-5-9-18)34-29(33)19-14-15-22-23(16-19)31-27-21-13-7-11-17-10-6-12-20(25(17)21)26(27)30-22/h3-12,14,16,20,24,31H,2,13,15H2,1H3/t20?,24-/m1/s1