N-[3-[(4-ethoxyphenyl)amino]-3-oxidanylidene-propyl]-2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[3-[(4-ethoxyphenyl)amino]-3-oxidanylidene-propyl]-2-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[3-(4-ethoxyanilino)-3-oxo-propyl]-2-(3-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[3-(4-ethoxyanilino)-3-oxopropyl]-2-(3-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[3-(4-ethoxyanilino)-3-oxopropyl]-2-(3-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 1-keto-N-[3-keto-3-(p-phenetidino)propyl]-2-(3-methoxyphenyl)isoquinoline-4-carboxamide Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCNC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCNC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC(=CC=C4)OC

InChI

InChI=1S/C28H27N3O5/c1-3-36-21-13-11-19(12-14-21)30-26(32)15-16-29-27(33)25-18-31(20-7-6-8-22(17-20)35-2)28(34)24-10-5-4-9-23(24)25/h4-14,17-18H,3,15-16H2,1-2H3,(H,29,33)(H,30,32)