4-[4-(6,7-dimethoxyisoquinolin-4-yl)carbonylpiperazin-1-yl]-3-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 4-[4-(6,7-dimethoxyisoquinolin-4-yl)carbonylpiperazin-1-yl]-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 4-[4-(6,7-dimethoxyisoquinoline-4-carbonyl)piperazin-1-yl]-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 4-[4-[(6,7-dimethoxy-4-isoquinolinyl)-oxomethyl]-1-piperazinyl]-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 4-[4-(6,7-dimethoxyisoquinoline-4-carbonyl)piperazin-1-yl]-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: 4-[4-(6,7-dimethoxyisoquinoline-4-carbonyl)piperazino]-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)CC=C1N2CCN(CC2)C(=O)C3=CN=CC4=CC(=C(C=C43)OC)OC

Isomeric SMILES

COC1=CC(=O)CC=C1N2CCN(CC2)C(=O)C3=CN=CC4=CC(=C(C=C43)OC)OC

InChI

InChI=1S/C23H25N3O5/c1-29-20-11-16(27)4-5-19(20)25-6-8-26(9-7-25)23(28)18-14-24-13-15-10-21(30-2)22(31-3)12-17(15)18/h5,10-14H,4,6-9H2,1-3H3