butanedioic acid; piperidin-1-yl-[3-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methanone

Systemtic Name: butanedioic acid; piperidin-1-yl-[3-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methanone Openeye Name: [3-[[4-(2-isopropoxyphenyl)piperazin-1-yl]methyl]phenyl]-(1-piperidyl)methanone; succinic acid CAS Name: butanedioic acid; 1-piperidinyl-[3-[[4-(2-propan-2-yloxyphenyl)-1-piperazinyl]methyl]phenyl]methanone IUPAC Name: butanedioic acid; piperidin-1-yl-[3-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methanone Traditional Name: [3-[[4-(2-isopropoxyphenyl)piperazino]methyl]phenyl]-piperidino-methanone; succinic acid Formula: C30H41N3O6 MolecularWeight: 539.66304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1N2CCN(CC2)CC3=CC=CC(=C3)C(=O)N4CCCCC4.C(CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)OC1=CC=CC=C1N2CCN(CC2)CC3=CC=CC(=C3)C(=O)N4CCCCC4.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C26H35N3O2.C4H6O4/c1-21(2)31-25-12-5-4-11-24(25)28-17-15-27(16-18-28)20-22-9-8-10-23(19-22)26(30)29-13-6-3-7-14-29;5-3(6)1-2-4(7)8/h4-5,8-12,19,21H,3,6-7,13-18,20H2,1-2H3;1-2H2,(H,5,6)(H,7,8)