7-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-2-piperidin-1-yl-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one

Systemtic Name: 7-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-2-piperidin-1-yl-4-propan-2-yl-cyclohepta-2,4,6-trien-1-one Openeye Name: 7-[(4-benzhydrylpiperazin-1-yl)methyl]-4-isopropyl-2-(1-piperidyl)cyclohepta-2,4,6-trien-1-one CAS Name: 7-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-2-(1-piperidinyl)-4-propan-2-yl-1-cyclohepta-2,4,6-trienone IUPAC Name: 7-[(4-benzhydrylpiperazin-1-yl)methyl]-2-piperidin-1-yl-4-propan-2-ylcyclohepta-2,4,6-trien-1-one Traditional Name: 7-[(4-benzhydrylpiperazino)methyl]-4-isopropyl-2-piperidino-cyclohepta-2,4,6-trien-1-one Formula: C33H41N3O MolecularWeight: 495.69814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C(=O)C(=C1)N2CCCCC2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CC=C(C(=O)C(=C1)N2CCCCC2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H41N3O/c1-26(2)29-16-17-30(33(37)31(24-29)35-18-10-5-11-19-35)25-34-20-22-36(23-21-34)32(27-12-6-3-7-13-27)28-14-8-4-9-15-28/h3-4,6-9,12-17,24,26,32H,5,10-11,18-23,25H2,1-2H3