1-[[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-5-propan-2-yl-indole-2,3-dione

Systemtic Name: 1-[[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-5-propan-2-yl-indole-2,3-dione Openeye Name: 5-isopropyl-1-[[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]indoline-2,3-dione CAS Name: 1-[[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]methyl]-5-propan-2-ylindole-2,3-dione IUPAC Name: 1-[[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]methyl]-5-propan-2-ylindole-2,3-dione Traditional Name: 5-isopropyl-1-[(4-p-anisylpiperazine-1,4-diium-1-yl)methyl]isatin Formula: C24H31N3O3+2 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(=O)C2=O)C[NH+]3CC[NH+](CC3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(=O)C2=O)C[NH+]3CC[NH+](CC3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H29N3O3/c1-17(2)19-6-9-22-21(14-19)23(28)24(29)27(22)16-26-12-10-25(11-13-26)15-18-4-7-20(30-3)8-5-18/h4-9,14,17H,10-13,15-16H2,1-3H3/p+2