(3-methylphenyl)-[3-[4-(2-phenoxyethyl)piperazin-1-yl]piperidin-1-yl]methanone

Systemtic Name: (3-methylphenyl)-[3-[4-(2-phenoxyethyl)piperazin-1-yl]piperidin-1-yl]methanone Openeye Name: m-tolyl-[3-[4-(2-phenoxyethyl)piperazin-1-yl]-1-piperidyl]methanone CAS Name: (3-methylphenyl)-[3-[4-(2-phenoxyethyl)-1-piperazinyl]-1-piperidinyl]methanone IUPAC Name: (3-methylphenyl)-[3-[4-(2-phenoxyethyl)piperazin-1-yl]piperidin-1-yl]methanone Traditional Name: m-tolyl-[3-[4-(2-phenoxyethyl)piperazino]piperidino]methanone Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCCC(C2)N3CCN(CC3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCCC(C2)N3CCN(CC3)CCOC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O2/c1-21-7-5-8-22(19-21)25(29)28-12-6-9-23(20-28)27-15-13-26(14-16-27)17-18-30-24-10-3-2-4-11-24/h2-5,7-8,10-11,19,23H,6,9,12-18,20H2,1H3