1-[4-[(4-tert-butylpiperazin-1-yl)-phenyl-methyl]piperidin-1-yl]-3,3-bis(2-methylphenyl)propan-1-one

Systemtic Name: 1-[4-[(4-tert-butylpiperazin-1-yl)-phenyl-methyl]piperidin-1-yl]-3,3-bis(2-methylphenyl)propan-1-one Openeye Name: 1-[4-[(4-tert-butylpiperazin-1-yl)-phenyl-methyl]-1-piperidyl]-3,3-bis(o-tolyl)propan-1-one CAS Name: 1-[4-[(4-tert-butyl-1-piperazinyl)-phenylmethyl]-1-piperidinyl]-3,3-bis(2-methylphenyl)-1-propanone IUPAC Name: 1-[4-[(4-tert-butylpiperazin-1-yl)-phenylmethyl]piperidin-1-yl]-3,3-bis(2-methylphenyl)propan-1-one Traditional Name: 1-[4-[(4-tert-butylpiperazino)-phenyl-methyl]piperidino]-3,3-bis(o-tolyl)propan-1-one Formula: C37H49N3O MolecularWeight: 551.80446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CC(=O)N2CCC(CC2)C(C3=CC=CC=C3)N4CCN(CC4)C(C)(C)C)C5=CC=CC=C5C

Isomeric SMILES

CC1=CC=CC=C1C(CC(=O)N2CCC(CC2)C(C3=CC=CC=C3)N4CCN(CC4)C(C)(C)C)C5=CC=CC=C5C

InChI

InChI=1S/C37H49N3O/c1-28-13-9-11-17-32(28)34(33-18-12-10-14-29(33)2)27-35(41)38-21-19-31(20-22-38)36(30-15-7-6-8-16-30)39-23-25-40(26-24-39)37(3,4)5/h6-18,31,34,36H,19-27H2,1-5H3