methyl N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]carbamate

Systemtic Name: methyl N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]carbamate Openeye Name: methyl N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]carbamate CAS Name: N-[2-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]carbamate Traditional Name: N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]carbamic acid methyl ester Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O3/c1-26-20(25)21-18-10-6-5-9-17(18)19(24)23-13-11-22(12-14-23)15-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3,(H,21,25)/p+1