5-azanyl-N-butyl-2,7,7-trimethyl-4-oxidanyl-9-oxidanylidene-9-(3-phenyl-3,4-dihydro-2H-quinolin-1-yl)nonanamide

Systemtic Name: 5-azanyl-N-butyl-2,7,7-trimethyl-4-oxidanyl-9-oxidanylidene-9-(3-phenyl-3,4-dihydro-2H-quinolin-1-yl)nonanamide Openeye Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-oxo-9-(3-phenyl-3,4-dihydro-2H-quinolin-1-yl)nonanamide CAS Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-oxo-9-(3-phenyl-3,4-dihydro-2H-quinolin-1-yl)nonanamide IUPAC Name: 5-amino-N-butyl-4-hydroxy-2,7,7-trimethyl-9-oxo-9-(3-phenyl-3,4-dihydro-2H-quinolin-1-yl)nonanamide Traditional Name: 5-amino-N-butyl-4-hydroxy-9-keto-2,7,7-trimethyl-9-(3-phenyl-3,4-dihydro-2H-quinolin-1-yl)pelargonamide Formula: C31H45N3O3 MolecularWeight: 507.7073

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CC(CC2=CC=CC=C21)C3=CC=CC=C3)N)O

Isomeric SMILES

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CC(CC2=CC=CC=C21)C3=CC=CC=C3)N)O

InChI

InChI=1S/C31H45N3O3/c1-5-6-16-33-30(37)22(2)17-28(35)26(32)19-31(3,4)20-29(36)34-21-25(23-12-8-7-9-13-23)18-24-14-10-11-15-27(24)34/h7-15,22,25-26,28,35H,5-6,16-21,32H2,1-4H3,(H,33,37)