[4-(4-carbamimidoylphenyl)carbonylpiperazin-1-yl] N-butylcarbamate

Systemtic Name: [4-(4-carbamimidoylphenyl)carbonylpiperazin-1-yl] N-butylcarbamate Openeye Name: [4-(4-carbamimidoylbenzoyl)piperazin-1-yl] N-butylcarbamate CAS Name: N-butylcarbamic acid [4-[(4-carbamimidoylphenyl)-oxomethyl]-1-piperazinyl] ester IUPAC Name: [4-(4-carbamimidoylbenzoyl)piperazin-1-yl] N-butylcarbamate Traditional Name: N-butylcarbamic acid [4-(4-amidinobenzoyl)piperazino] ester Formula: C17H25N5O3 MolecularWeight: 347.4121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)ON1CCN(CC1)C(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCCCNC(=O)ON1CCN(CC1)C(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H25N5O3/c1-2-3-8-20-17(24)25-22-11-9-21(10-12-22)16(23)14-6-4-13(5-7-14)15(18)19/h4-7H,2-3,8-12H2,1H3,(H3,18,19)(H,20,24)