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

Systemtic Name: N-[2-(2-methoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide Openeye Name: N-[2-(2-methoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxo-4-phenyl-isoquinoline-3-carboxamide CAS Name: N-[2-(2-methoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinecarboxamide IUPAC Name: N-[2-(2-methoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxo-4-phenylisoquinoline-3-carboxamide Traditional Name: 1-keto-N-[2-(2-methoxyphenyl)ethyl]-2,6,7-trimethyl-4-phenyl-isoquinoline-3-carboxamide Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)C(=O)NCCC3=CC=CC=C3OC)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(N(C2=O)C)C(=O)NCCC3=CC=CC=C3OC)C4=CC=CC=C4)C

InChI

InChI=1S/C28H28N2O3/c1-18-16-22-23(17-19(18)2)28(32)30(3)26(25(22)21-11-6-5-7-12-21)27(31)29-15-14-20-10-8-9-13-24(20)33-4/h5-13,16-17H,14-15H2,1-4H3,(H,29,31)