2-(4-chlorophenyl)-7-methoxy-4-(piperidin-1-ylmethylidene)isoquinoline-1,3-dione

Systemtic Name: 2-(4-chlorophenyl)-7-methoxy-4-(piperidin-1-ylmethylidene)isoquinoline-1,3-dione Openeye Name: 2-(4-chlorophenyl)-7-methoxy-4-(1-piperidylmethylene)isoquinoline-1,3-dione CAS Name: 2-(4-chlorophenyl)-7-methoxy-4-(1-piperidinylmethylidene)isoquinoline-1,3-dione IUPAC Name: 2-(4-chlorophenyl)-7-methoxy-4-(piperidin-1-ylmethylidene)isoquinoline-1,3-dione Traditional Name: 2-(4-chlorophenyl)-7-methoxy-4-(piperidinomethylene)isoquinoline-1,3-quinone Formula: C22H21ClN2O3 MolecularWeight: 396.86674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CN3CCCCC3)C(=O)N(C2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CN3CCCCC3)C(=O)N(C2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H21ClN2O3/c1-28-17-9-10-18-19(13-17)21(26)25(16-7-5-15(23)6-8-16)22(27)20(18)14-24-11-3-2-4-12-24/h5-10,13-14H,2-4,11-12H2,1H3