cyclohexyl (4S)-2,7,7-trimethyl-4-naphthalen-1-yl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: cyclohexyl (4S)-2,7,7-trimethyl-4-naphthalen-1-yl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: cyclohexyl (4S)-2,7,7-trimethyl-4-(1-naphthyl)-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4S)-2,7,7-trimethyl-4-(1-naphthalenyl)-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl (4S)-2,7,7-trimethyl-4-naphthalen-1-yl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4S)-5-keto-2,7,7-trimethyl-4-(1-naphthyl)-3,4,6,8-tetrahydroquinoline-3-carboxylic acid cyclohexyl ester Formula: C29H33NO3 MolecularWeight: 443.57722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC3CCCCC3)C4=CC=CC5=CC=CC=C54)C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC3CCCCC3)C4=CC=CC5=CC=CC=C54)C(=O)CC(C2)(C)C

InChI

InChI=1S/C29H33NO3/c1-18-25(28(32)33-20-12-5-4-6-13-20)26(22-15-9-11-19-10-7-8-14-21(19)22)27-23(30-18)16-29(2,3)17-24(27)31/h7-11,14-15,20,25-26H,4-6,12-13,16-17H2,1-3H3/t25?,26-/m1/s1