N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxidanylidene-4H-isoquinoline-3-carboxamide

Systemtic Name: N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxidanylidene-4H-isoquinoline-3-carboxamide Openeye Name: N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide CAS Name: N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide IUPAC Name: N-cycloheptyl-2-[(4-methoxyphenyl)methyl]-3-methyl-1-oxo-4H-isoquinoline-3-carboxamide Traditional Name: N-cycloheptyl-1-keto-3-methyl-2-p-anisyl-4H-isoquinoline-3-carboxamide Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)OC)C(=O)NC4CCCCCC4

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)OC)C(=O)NC4CCCCCC4

InChI

InChI=1S/C26H32N2O3/c1-26(25(30)27-21-10-5-3-4-6-11-21)17-20-9-7-8-12-23(20)24(29)28(26)18-19-13-15-22(31-2)16-14-19/h7-9,12-16,21H,3-6,10-11,17-18H2,1-2H3,(H,27,30)