(E)-N-[4-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]-3-cyano-7-ethoxy-quinolin-6-yl]-4-pyrrolidin-1-yl-but-2-enamide

Systemtic Name: (E)-N-[4-[(3-chloranyl-4-phenylmethoxy-phenyl)amino]-3-cyano-7-ethoxy-quinolin-6-yl]-4-pyrrolidin-1-yl-but-2-enamide Openeye Name: (E)-N-[4-(4-benzyloxy-3-chloro-anilino)-3-cyano-7-ethoxy-6-quinolyl]-4-pyrrolidin-1-yl-but-2-enamide CAS Name: (E)-N-[4-(3-chloro-4-phenylmethoxyanilino)-3-cyano-7-ethoxy-6-quinolinyl]-4-(1-pyrrolidinyl)-2-butenamide IUPAC Name: (E)-N-[4-(3-chloro-4-phenylmethoxyanilino)-3-cyano-7-ethoxyquinolin-6-yl]-4-pyrrolidin-1-ylbut-2-enamide Traditional Name: (E)-N-[4-(4-benzoxy-3-chloro-anilino)-3-cyano-7-ethoxy-6-quinolyl]-4-pyrrolidino-but-2-enamide Formula: C33H32ClN5O3 MolecularWeight: 582.09188

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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=CCN5CCCC5

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/CN5CCCC5

InChI

InChI=1S/C33H32ClN5O3/c1-2-41-31-19-28-26(18-29(31)38-32(40)11-8-16-39-14-6-7-15-39)33(24(20-35)21-36-28)37-25-12-13-30(27(34)17-25)42-22-23-9-4-3-5-10-23/h3-5,8-13,17-19,21H,2,6-7,14-16,22H2,1H3,(H,36,37)(H,38,40)/b11-8+