1-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-5-methyl-indole-2,3-dione

Systemtic Name: 1-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-5-methyl-indole-2,3-dione Openeye Name: 1-[(4-benzhydrylpiperazin-1-yl)methyl]-5-methyl-indoline-2,3-dione CAS Name: 1-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-5-methylindole-2,3-dione IUPAC Name: 1-[(4-benzhydrylpiperazin-1-yl)methyl]-5-methylindole-2,3-dione Traditional Name: 1-[(4-benzhydrylpiperazino)methyl]-5-methyl-isatin Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=O)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2/c1-20-12-13-24-23(18-20)26(31)27(32)30(24)19-28-14-16-29(17-15-28)25(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-13,18,25H,14-17,19H2,1H3