N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-(2-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-2-(2-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]-2-(2-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-2-(2-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]-1-keto-2-(2-methoxyphenyl)isoquinoline-4-carboxamide Formula: C26H22FN3O4 MolecularWeight: 459.468983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C3=CC=CC=C3C2=O)C(=O)NCC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C26H22FN3O4/c1-34-23-9-5-4-8-22(23)30-16-21(19-6-2-3-7-20(19)26(30)33)25(32)29-15-24(31)28-14-17-10-12-18(27)13-11-17/h2-13,16H,14-15H2,1H3,(H,28,31)(H,29,32)