N-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-2-(2-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[2-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-2-(2-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[2-(5-chloro-2,4-dimethoxy-anilino)-2-oxo-ethyl]-2-(2-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[2-(5-chloro-2,4-dimethoxyanilino)-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[2-(5-chloro-2,4-dimethoxy-anilino)-2-keto-ethyl]-1-keto-2-(2-methoxyphenyl)isoquinoline-4-carboxamide Formula: C27H24ClN3O6 MolecularWeight: 521.94896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)NC4=CC(=C(C=C4OC)OC)Cl

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)NC4=CC(=C(C=C4OC)OC)Cl

InChI

InChI=1S/C27H24ClN3O6/c1-35-22-11-7-6-10-21(22)31-15-18(16-8-4-5-9-17(16)27(31)34)26(33)29-14-25(32)30-20-12-19(28)23(36-2)13-24(20)37-3/h4-13,15H,14H2,1-3H3,(H,29,33)(H,30,32)