N-[4-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]-3-cyano-7-ethoxy-quinolin-6-yl]-2-(dimethylaminomethyl)prop-2-enamide

Systemtic Name: N-[4-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]-3-cyano-7-ethoxy-quinolin-6-yl]-2-(dimethylaminomethyl)prop-2-enamide Openeye Name: N-[4-(4-benzyloxy-3-chloro-anilino)-3-cyano-7-ethoxy-6-quinolyl]-2-(dimethylaminomethyl)prop-2-enamide CAS Name: N-[4-(3-chloro-4-phenylmethoxyanilino)-3-cyano-7-ethoxy-6-quinolinyl]-2-(dimethylaminomethyl)-2-propenamide IUPAC Name: N-[4-(3-chloro-4-phenylmethoxyanilino)-3-cyano-7-ethoxyquinolin-6-yl]-2-(dimethylaminomethyl)prop-2-enamide Traditional Name: N-[4-(4-benzoxy-3-chloro-anilino)-3-cyano-7-ethoxy-6-quinolyl]-2-(dimethylaminomethyl)acrylamide Formula: C31H30ClN5O3 MolecularWeight: 556.0546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=C4)Cl)C#N)NC(=O)C(=C)CN(C)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=C4)Cl)C#N)NC(=O)C(=C)CN(C)C

InChI

InChI=1S/C31H30ClN5O3/c1-5-39-29-15-26-24(14-27(29)36-31(38)20(2)18-37(3)4)30(22(16-33)17-34-26)35-23-11-12-28(25(32)13-23)40-19-21-9-7-6-8-10-21/h6-15,17H,2,5,18-19H2,1,3-4H3,(H,34,35)(H,36,38)