3-[2-[1-(4-carbamimidoylphenyl)piperidin-4-yl]ethanoylamino]propanoic acid

Systemtic Name: 3-[2-[1-(4-carbamimidoylphenyl)piperidin-4-yl]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[1-(4-carbamimidoylphenyl)-4-piperidyl]acetyl]amino]propanoic acid CAS Name: 3-[[2-[1-(4-carbamimidoylphenyl)-4-piperidinyl]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-[1-(4-carbamimidoylphenyl)piperidin-4-yl]acetyl]amino]propanoic acid Traditional Name: 3-[[2-[1-(4-amidinophenyl)-4-piperidyl]acetyl]amino]propionic acid Formula: C17H24N4O3 MolecularWeight: 332.39746

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)NCCC(=O)O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1CN(CCC1CC(=O)NCCC(=O)O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H24N4O3/c18-17(19)13-1-3-14(4-2-13)21-9-6-12(7-10-21)11-15(22)20-8-5-16(23)24/h1-4,12H,5-11H2,(H3,18,19)(H,20,22)(H,23,24)