(4aS,8R,8aS)-2-butyl-1-oxidanylidene-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide

Systemtic Name: (4aS,8R,8aS)-2-butyl-1-oxidanylidene-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide Openeye Name: (4aS,8R,8aS)-2-butyl-1-oxo-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide CAS Name: (4aS,8R,8aS)-2-butyl-1-oxo-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide IUPAC Name: (4aS,8R,8aS)-2-butyl-1-oxo-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide Traditional Name: (4aS,8R,8aS)-2-butyl-1-keto-N-phenyl-3,4,4a,7,8,8a-hexahydroisoquinoline-8-carboxamide Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC2C=CCC(C2C1=O)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCN1CC[C@H]2C=CC[C@H]([C@H]2C1=O)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O2/c1-2-3-13-22-14-12-15-8-7-11-17(18(15)20(22)24)19(23)21-16-9-5-4-6-10-16/h4-10,15,17-18H,2-3,11-14H2,1H3,(H,21,23)/t15-,17-,18+/m1/s1