ethyl 4-[[4-(4-carbamimidoylphenyl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-[[4-(4-carbamimidoylphenyl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: ethyl 4-[[4-(4-carbamimidoylphenyl)piperidine-1-carbonyl]amino]cyclohexanecarboxylate CAS Name: 4-[[[4-(4-carbamimidoylphenyl)-1-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4-carbamimidoylphenyl)piperidine-1-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[4-(4-amidinophenyl)piperidine-1-carbonyl]amino]cyclohexanecarboxylic acid ethyl ester Formula: C22H32N4O3 MolecularWeight: 400.51448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)NC(=O)N2CCC(CC2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)C1CCC(CC1)NC(=O)N2CCC(CC2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H32N4O3/c1-2-29-21(27)18-7-9-19(10-8-18)25-22(28)26-13-11-16(12-14-26)15-3-5-17(6-4-15)20(23)24/h3-6,16,18-19H,2,7-14H2,1H3,(H3,23,24)(H,25,28)