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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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