[1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-isoquinolyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [1-[4-(2-methoxyphenyl)-1-piperazinyl]-4-isoquinolinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [1-[4-(2-methoxyphenyl)piperazin-1-yl]isoquinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [1-[4-(2-methoxyphenyl)piperazino]-4-isoquinolyl]-(4-phenylpiperazino)methanone Formula: C31H33N5O2 MolecularWeight: 507.62602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C4=CC=CC=C43)C(=O)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=NC=C(C4=CC=CC=C43)C(=O)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C31H33N5O2/c1-38-29-14-8-7-13-28(29)34-17-19-35(20-18-34)30-26-12-6-5-11-25(26)27(23-32-30)31(37)36-21-15-33(16-22-36)24-9-3-2-4-10-24/h2-14,23H,15-22H2,1H3