2-[1-[(3S)-3-[(4-carbamimidoylphenyl)carbonylamino]butanoyl]piperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[(3S)-3-[(4-carbamimidoylphenyl)carbonylamino]butanoyl]piperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[(3S)-3-[(4-carbamimidoylbenzoyl)amino]butanoyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[(3S)-3-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-oxobutyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[(3S)-3-[(4-carbamimidoylbenzoyl)amino]butanoyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[(3S)-3-[(4-amidinobenzoyl)amino]butanoyl]-4-piperidyl]acetic acid Formula: C19H26N4O4 MolecularWeight: 374.43414

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCC(CC1)CC(=O)O)NC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C[C@@H](CC(=O)N1CCC(CC1)CC(=O)O)NC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H26N4O4/c1-12(22-19(27)15-4-2-14(3-5-15)18(20)21)10-16(24)23-8-6-13(7-9-23)11-17(25)26/h2-5,12-13H,6-11H2,1H3,(H3,20,21)(H,22,27)(H,25,26)/t12-/m0/s1