N-[(3-methoxyphenyl)methyl]-2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide Openeye Name: N-[(3-methoxyphenyl)methyl]-2,6,7-trimethyl-1-oxo-4-phenyl-isoquinoline-3-carboxamide CAS Name: N-[(3-methoxyphenyl)methyl]-2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinecarboxamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-2,6,7-trimethyl-1-oxo-4-phenylisoquinoline-3-carboxamide Traditional Name: 1-keto-N-m-anisyl-2,6,7-trimethyl-4-phenyl-isoquinoline-3-carboxamide Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)C(=O)NCC3=CC(=CC=C3)OC)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)C(=O)NCC3=CC(=CC=C3)OC)C4=CC=CC=C4)C

InChI

InChI=1S/C27H26N2O3/c1-17-13-22-23(14-18(17)2)27(31)29(3)25(24(22)20-10-6-5-7-11-20)26(30)28-16-19-9-8-12-21(15-19)32-4/h5-15H,16H2,1-4H3,(H,28,30)