N-[3-cyano-4-[(phenylmethyl)amino]quinolin-2-yl]-4-methoxy-N-(4-methoxyphenyl)carbonyl-benzamide

Systemtic Name: N-[3-cyano-4-[(phenylmethyl)amino]quinolin-2-yl]-4-methoxy-N-(4-methoxyphenyl)carbonyl-benzamide Openeye Name: N-[4-(benzylamino)-3-cyano-2-quinolyl]-4-methoxy-N-(4-methoxybenzoyl)benzamide CAS Name: N-[3-cyano-4-[(phenylmethyl)amino]-2-quinolinyl]-4-methoxy-N-[(4-methoxyphenyl)-oxomethyl]benzamide IUPAC Name: N-[4-(benzylamino)-3-cyanoquinolin-2-yl]-4-methoxy-N-(4-methoxybenzoyl)benzamide Traditional Name: N-[4-(benzylamino)-3-cyano-2-quinolyl]-4-methoxy-N-p-anisoyl-benzamide Formula: C33H26N4O4 MolecularWeight: 542.58394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(C2=NC3=CC=CC=C3C(=C2C#N)NCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(C2=NC3=CC=CC=C3C(=C2C#N)NCC4=CC=CC=C4)C(=O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C33H26N4O4/c1-40-25-16-12-23(13-17-25)32(38)37(33(39)24-14-18-26(41-2)19-15-24)31-28(20-34)30(27-10-6-7-11-29(27)36-31)35-21-22-8-4-3-5-9-22/h3-19H,21H2,1-2H3,(H,35,36)