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

Systemtic Name: cyclohexyl 4-[[4-(4-carbamimidoylphenyl)piperidin-1-yl]carbonylamino]cyclohexane-1-carboxylate hydrochloride Openeye Name: cyclohexyl 4-[[4-(4-carbamimidoylphenyl)piperidine-1-carbonyl]amino]cyclohexanecarboxylate hydrochloride CAS Name: 4-[[[4-(4-carbamimidoylphenyl)-1-piperidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid cyclohexyl ester hydrochloride IUPAC Name: cyclohexyl 4-[[4-(4-carbamimidoylphenyl)piperidine-1-carbonyl]amino]cyclohexane-1-carboxylate hydrochloride Traditional Name: 4-[[4-(4-amidinophenyl)piperidine-1-carbonyl]amino]cyclohexanecarboxylic acid cyclohexyl ester hydrochloride Formula: C26H39ClN4O3 MolecularWeight: 491.06586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2CCC(CC2)NC(=O)N3CCC(CC3)C4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)C2CCC(CC2)NC(=O)N3CCC(CC3)C4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C26H38N4O3.ClH/c27-24(28)20-8-6-18(7-9-20)19-14-16-30(17-15-19)26(32)29-22-12-10-21(11-13-22)25(31)33-23-4-2-1-3-5-23;/h6-9,19,21-23H,1-5,10-17H2,(H3,27,28)(H,29,32);1H