N-[(E)-(4-methoxyphenyl)methylideneamino]-2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide

Systemtic Name: N-[(E)-(4-methoxyphenyl)methylideneamino]-2-methyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide Openeye Name: N-[(E)-(4-methoxyphenyl)methyleneamino]-2-methyl-1-oxo-4-phenyl-isoquinoline-3-carboxamide CAS Name: N-[(E)-(4-methoxyphenyl)methylideneamino]-2-methyl-1-oxo-4-phenyl-3-isoquinolinecarboxamide IUPAC Name: N-[(E)-(4-methoxyphenyl)methylideneamino]-2-methyl-1-oxo-4-phenylisoquinoline-3-carboxamide Traditional Name: 1-keto-2-methyl-N-[(E)-p-anisylideneamino]-4-phenyl-isoquinoline-3-carboxamide Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)C(=O)NN=CC4=CC=C(C=C4)OC

Isomeric SMILES

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)C(=O)N/N=C/C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H21N3O3/c1-28-23(24(29)27-26-16-17-12-14-19(31-2)15-13-17)22(18-8-4-3-5-9-18)20-10-6-7-11-21(20)25(28)30/h3-16H,1-2H3,(H,27,29)/b26-16+