ethyl N-[4-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]carbamate

Systemtic Name: ethyl N-[4-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonylphenyl]carbamate Openeye Name: ethyl N-[4-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]carbamate CAS Name: N-[4-[[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[4-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]phenyl]carbamate Traditional Name: N-[4-(4-p-anisylpiperazin-4-ium-1-carbonyl)phenyl]carbamic acid ethyl ester Formula: C22H28N3O4+ MolecularWeight: 398.47542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)NC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O4/c1-3-29-22(27)23-19-8-6-18(7-9-19)21(26)25-14-12-24(13-15-25)16-17-4-10-20(28-2)11-5-17/h4-11H,3,12-16H2,1-2H3,(H,23,27)/p+1