1-azanyl-N-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-N-phenyl-isoquinoline-7-carboxamide

Systemtic Name: 1-azanyl-N-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]-N-phenyl-isoquinoline-7-carboxamide Openeye Name: 1-amino-N-[2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]-N-phenyl-isoquinoline-7-carboxamide CAS Name: 1-amino-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-N-phenyl-7-isoquinolinecarboxamide IUPAC Name: 1-amino-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]-N-phenylisoquinoline-7-carboxamide Traditional Name: 1-amino-N-[2-keto-2-(p-anisylamino)ethyl]-N-phenyl-isoquinoline-7-carboxamide Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CN(C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C=CN=C4N

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CN(C2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C=CN=C4N

InChI

InChI=1S/C26H24N4O3/c1-33-22-11-7-18(8-12-22)16-29-24(31)17-30(21-5-3-2-4-6-21)26(32)20-10-9-19-13-14-28-25(27)23(19)15-20/h2-15H,16-17H2,1H3,(H2,27,28)(H,29,31)