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

Systemtic Name: 4-bromanyl-5-methyl-1-[[4-(phenylmethyl)piperazin-1-yl]methyl]indole-2,3-dione Openeye Name: 1-[(4-benzylpiperazin-1-yl)methyl]-4-bromo-5-methyl-indoline-2,3-dione CAS Name: 4-bromo-5-methyl-1-[[4-(phenylmethyl)-1-piperazinyl]methyl]indole-2,3-dione IUPAC Name: 1-[(4-benzylpiperazin-1-yl)methyl]-4-bromo-5-methylindole-2,3-dione Traditional Name: 1-[(4-benzylpiperazino)methyl]-4-bromo-5-methyl-isatin Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N(C(=O)C2=O)CN3CCN(CC3)CC4=CC=CC=C4)Br

Isomeric SMILES

CC1=C(C2=C(C=C1)N(C(=O)C2=O)CN3CCN(CC3)CC4=CC=CC=C4)Br

InChI

InChI=1S/C21H22BrN3O2/c1-15-7-8-17-18(19(15)22)20(26)21(27)25(17)14-24-11-9-23(10-12-24)13-16-5-3-2-4-6-16/h2-8H,9-14H2,1H3