2-[1-[2-[[(4-carbamimidoylphenyl)carbonylamino]-phenyl-methyl]butanoyl]piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[2-[[(4-carbamimidoylphenyl)carbonylamino]-phenyl-methyl]butanoyl]piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[2-[[(4-carbamimidoylbenzoyl)amino]-phenyl-methyl]butanoyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[2-[[[(4-carbamimidoylphenyl)-oxomethyl]amino]-phenylmethyl]-1-oxobutyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[2-[[(4-carbamimidoylbenzoyl)amino]-phenylmethyl]butanoyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[2-[[(4-amidinobenzoyl)amino]-phenyl-methyl]butanoyl]-4-piperidyl]acetic acid Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)C(=N)N)C(=O)N3CCC(CC3)CC(=O)O

Isomeric SMILES

CCC(C(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)C(=N)N)C(=O)N3CCC(CC3)CC(=O)O

InChI

InChI=1S/C26H32N4O4/c1-2-21(26(34)30-14-12-17(13-15-30)16-22(31)32)23(18-6-4-3-5-7-18)29-25(33)20-10-8-19(9-11-20)24(27)28/h3-11,17,21,23H,2,12-16H2,1H3,(H3,27,28)(H,29,33)(H,31,32)