cyclohexyl 2-[1-[1-(4-carbamimidoylphenyl)piperidin-4-yl]carbonylpiperidin-4-yl]ethanoate dihydrochloride

Systemtic Name: cyclohexyl 2-[1-[1-(4-carbamimidoylphenyl)piperidin-4-yl]carbonylpiperidin-4-yl]ethanoate dihydrochloride Openeye Name: cyclohexyl 2-[1-[1-(4-carbamimidoylphenyl)piperidine-4-carbonyl]-4-piperidyl]acetate dihydrochloride CAS Name: 2-[1-[[1-(4-carbamimidoylphenyl)-4-piperidinyl]-oxomethyl]-4-piperidinyl]acetic acid cyclohexyl ester dihydrochloride IUPAC Name: cyclohexyl 2-[1-[1-(4-carbamimidoylphenyl)piperidine-4-carbonyl]piperidin-4-yl]acetate dihydrochloride Traditional Name: 2-[1-[1-(4-amidinophenyl)isonipecotoyl]-4-piperidyl]acetic acid cyclohexyl ester dihydrochloride Formula: C26H40Cl2N4O3 MolecularWeight: 527.5268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)CC2CCN(CC2)C(=O)C3CCN(CC3)C4=CC=C(C=C4)C(=N)N.Cl.Cl

Isomeric SMILES

C1CCC(CC1)OC(=O)CC2CCN(CC2)C(=O)C3CCN(CC3)C4=CC=C(C=C4)C(=N)N.Cl.Cl

InChI

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