1-[[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methyl]urea CAS Name: 1-[[4-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[4-(4-methylpiperazin-4-ium-1-carbonyl)benzyl]urea Formula: C17H27N4O2+ MolecularWeight: 319.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C17H26N4O2/c1-13(2)19-17(23)18-12-14-4-6-15(7-5-14)16(22)21-10-8-20(3)9-11-21/h4-7,13H,8-12H2,1-3H3,(H2,18,19,23)/p+1