4-(4-methylphenyl)-N-[2-[methyl-(phenylmethyl)amino]ethyl]-1-oxidanylidene-isochromene-3-carboxamide

Systemtic Name: 4-(4-methylphenyl)-N-[2-[methyl-(phenylmethyl)amino]ethyl]-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-[2-[benzyl(methyl)amino]ethyl]-1-oxo-4-(p-tolyl)isochromene-3-carboxamide CAS Name: 4-(4-methylphenyl)-N-[2-[methyl-(phenylmethyl)amino]ethyl]-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-[2-[benzyl(methyl)amino]ethyl]-4-(4-methylphenyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-[2-[benzyl(methyl)amino]ethyl]-1-keto-4-(p-tolyl)isochromene-3-carboxamide Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NCCN(C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)NCCN(C)CC4=CC=CC=C4

InChI

InChI=1S/C27H26N2O3/c1-19-12-14-21(15-13-19)24-22-10-6-7-11-23(22)27(31)32-25(24)26(30)28-16-17-29(2)18-20-8-4-3-5-9-20/h3-15H,16-18H2,1-2H3,(H,28,30)