(4-cyclobutylpiperazin-1-yl)-[2-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl]methanone

Systemtic Name: (4-cyclobutylpiperazin-1-yl)-[2-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl]methanone Openeye Name: (2-benzyl-3,4-dihydro-1H-isoquinolin-6-yl)-(4-cyclobutylpiperazin-1-yl)methanone CAS Name: (4-cyclobutyl-1-piperazinyl)-[2-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-6-yl]methanone IUPAC Name: (2-benzyl-3,4-dihydro-1H-isoquinolin-6-yl)-(4-cyclobutylpiperazin-1-yl)methanone Traditional Name: (2-benzyl-3,4-dihydro-1H-isoquinolin-6-yl)-(4-cyclobutylpiperazino)methanone Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCN(CC2)C(=O)C3=CC4=C(CN(CC4)CC5=CC=CC=C5)C=C3

Isomeric SMILES

C1CC(C1)N2CCN(CC2)C(=O)C3=CC4=C(CN(CC4)CC5=CC=CC=C5)C=C3

InChI

InChI=1S/C25H31N3O/c29-25(28-15-13-27(14-16-28)24-7-4-8-24)22-9-10-23-19-26(12-11-21(23)17-22)18-20-5-2-1-3-6-20/h1-3,5-6,9-10,17,24H,4,7-8,11-16,18-19H2