2-[4-(3-cyano-7-ethoxy-6-methoxy-quinolin-4-yl)piperazin-1-yl]-4-propan-2-yloxy-benzamide

Systemtic Name: 2-[4-(3-cyano-7-ethoxy-6-methoxy-quinolin-4-yl)piperazin-1-yl]-4-propan-2-yloxy-benzamide Openeye Name: 2-[4-(3-cyano-7-ethoxy-6-methoxy-4-quinolyl)piperazin-1-yl]-4-isopropoxy-benzamide CAS Name: 2-[4-(3-cyano-7-ethoxy-6-methoxy-4-quinolinyl)-1-piperazinyl]-4-propan-2-yloxybenzamide IUPAC Name: 2-[4-(3-cyano-7-ethoxy-6-methoxyquinolin-4-yl)piperazin-1-yl]-4-propan-2-yloxybenzamide Traditional Name: 2-[4-(3-cyano-7-ethoxy-6-methoxy-4-quinolyl)piperazino]-4-isopropoxy-benzamide Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CC(=C2N3CCN(CC3)C4=C(C=CC(=C4)OC(C)C)C(=O)N)C#N)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2N3CCN(CC3)C4=C(C=CC(=C4)OC(C)C)C(=O)N)C#N)OC

InChI

InChI=1S/C27H31N5O4/c1-5-35-25-14-22-21(13-24(25)34-4)26(18(15-28)16-30-22)32-10-8-31(9-11-32)23-12-19(36-17(2)3)6-7-20(23)27(29)33/h6-7,12-14,16-17H,5,8-11H2,1-4H3,(H2,29,33)