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

Systemtic Name: piperidin-4-yl 2-[1-[4-(4-carbamimidoylphenyl)phenyl]carbonylpiperidin-4-yl]ethanoate hydrochloride Openeye Name: 4-piperidyl 2-[1-[4-(4-carbamimidoylphenyl)benzoyl]-4-piperidyl]acetate hydrochloride CAS Name: 2-[1-[[4-(4-carbamimidoylphenyl)phenyl]-oxomethyl]-4-piperidinyl]acetic acid 4-piperidinyl ester hydrochloride IUPAC Name: piperidin-4-yl 2-[1-[4-(4-carbamimidoylphenyl)benzoyl]piperidin-4-yl]acetate hydrochloride Traditional Name: 2-[1-[4-(4-amidinophenyl)benzoyl]-4-piperidyl]acetic acid 4-piperidyl ester hydrochloride Formula: C26H33ClN4O3 MolecularWeight: 485.01822

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC(=O)CC2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=N)N.Cl

Isomeric SMILES

C1CNCCC1OC(=O)CC2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=N)N.Cl

InChI

InChI=1S/C26H32N4O3.ClH/c27-25(28)21-5-1-19(2-6-21)20-3-7-22(8-4-20)26(32)30-15-11-18(12-16-30)17-24(31)33-23-9-13-29-14-10-23;/h1-8,18,23,29H,9-17H2,(H3,27,28);1H