2-cyclopropyl-3-(3-methoxyphenyl)-1-oxidanylidene-N-phenethyl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-cyclopropyl-3-(3-methoxyphenyl)-1-oxidanylidene-N-phenethyl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-N-phenethyl-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-N-phenethyl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-cyclopropyl-3-(3-methoxyphenyl)-1-oxo-N-phenethyl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 2-cyclopropyl-1-keto-3-(3-methoxyphenyl)-N-phenethyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C28H28N2O3/c1-33-22-11-7-10-20(18-22)26-25(27(31)29-17-16-19-8-3-2-4-9-19)23-12-5-6-13-24(23)28(32)30(26)21-14-15-21/h2-13,18,21,25-26H,14-17H2,1H3,(H,29,31)