[4-(3-methoxyphenyl)piperazin-1-yl]-(1-piperidin-1-ylisoquinolin-4-yl)methanone

Systemtic Name: [4-(3-methoxyphenyl)piperazin-1-yl]-(1-piperidin-1-ylisoquinolin-4-yl)methanone Openeye Name: [4-(3-methoxyphenyl)piperazin-1-yl]-[1-(1-piperidyl)-4-isoquinolyl]methanone CAS Name: [4-(3-methoxyphenyl)-1-piperazinyl]-[1-(1-piperidinyl)-4-isoquinolinyl]methanone IUPAC Name: [4-(3-methoxyphenyl)piperazin-1-yl]-(1-piperidin-1-ylisoquinolin-4-yl)methanone Traditional Name: [4-(3-methoxyphenyl)piperazino]-(1-piperidino-4-isoquinolyl)methanone Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CN=C(C4=CC=CC=C43)N5CCCCC5

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CN=C(C4=CC=CC=C43)N5CCCCC5

InChI

InChI=1S/C26H30N4O2/c1-32-21-9-7-8-20(18-21)28-14-16-30(17-15-28)26(31)24-19-27-25(29-12-5-2-6-13-29)23-11-4-3-10-22(23)24/h3-4,7-11,18-19H,2,5-6,12-17H2,1H3