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

Systemtic Name: ethyl 2-[1-[1-(4-carbamimidoylphenyl)piperidin-4-yl]carbonylpiperidin-4-yl]ethanoate dihydrochloride Openeye Name: ethyl 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 ethyl ester dihydrochloride IUPAC Name: ethyl 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 ethyl ester dihydrochloride Formula: C22H34Cl2N4O3 MolecularWeight: 473.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=C(C=C3)C(=N)N.Cl.Cl

Isomeric SMILES

CCOC(=O)CC1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=C(C=C3)C(=N)N.Cl.Cl

InChI

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