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

Systemtic Name: 5-bromanyl-1-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]indole-2,3-dione Openeye Name: 1-[4-(4-benzhydrylpiperazin-1-yl)butyl]-5-bromo-indoline-2,3-dione CAS Name: 5-bromo-1-[4-[4-(diphenylmethyl)-1-piperazinyl]butyl]indole-2,3-dione IUPAC Name: 1-[4-(4-benzhydrylpiperazin-1-yl)butyl]-5-bromoindole-2,3-dione Traditional Name: 1-[4-(4-benzhydrylpiperazino)butyl]-5-bromo-isatin Formula: C29H30BrN3O2 MolecularWeight: 532.4714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C3=C(C=C(C=C3)Br)C(=O)C2=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCCN2C3=C(C=C(C=C3)Br)C(=O)C2=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H30BrN3O2/c30-24-13-14-26-25(21-24)28(34)29(35)33(26)16-8-7-15-31-17-19-32(20-18-31)27(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-6,9-14,21,27H,7-8,15-20H2