cyclopentyl 2-[1-[4-(4-carbamimidoylphenyl)phenyl]carbonylpiperidin-4-yl]ethanoate hydrochloride

Systemtic Name: cyclopentyl 2-[1-[4-(4-carbamimidoylphenyl)phenyl]carbonylpiperidin-4-yl]ethanoate hydrochloride Openeye Name: cyclopentyl 2-[1-[4-(4-carbamimidoylphenyl)benzoyl]-4-piperidyl]acetate hydrochloride CAS Name: 2-[1-[[4-(4-carbamimidoylphenyl)phenyl]-oxomethyl]-4-piperidinyl]acetic acid cyclopentyl ester hydrochloride IUPAC Name: cyclopentyl 2-[1-[4-(4-carbamimidoylphenyl)benzoyl]piperidin-4-yl]acetate hydrochloride Traditional Name: 2-[1-[4-(4-amidinophenyl)benzoyl]-4-piperidyl]acetic acid cyclopentyl ester hydrochloride Formula: C26H32ClN3O3 MolecularWeight: 470.00358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC(=O)CC2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

C1CCC(C1)OC(=O)CC2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C26H31N3O3.ClH/c27-25(28)21-9-5-19(6-10-21)20-7-11-22(12-8-20)26(31)29-15-13-18(14-16-29)17-24(30)32-23-3-1-2-4-23;/h5-12,18,23H,1-4,13-17H2,(H3,27,28);1H