N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-1-keto-2-(4-methoxyphenyl)isoquinoline-4-carboxamide Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCN4CCC5=CC=CC=C5C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H27N3O3/c1-34-23-12-10-22(11-13-23)31-19-26(24-8-4-5-9-25(24)28(31)33)27(32)29-15-17-30-16-14-20-6-2-3-7-21(20)18-30/h2-13,19H,14-18H2,1H3,(H,29,32)