3-[2-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]ethanoylamino]butanoic acid

Systemtic Name: 3-[2-[1-(4-carbamimidoylphenyl)-2-oxidanylidene-pyrrolidin-3-yl]ethanoylamino]butanoic acid Openeye Name: 3-[[2-[1-(4-carbamimidoylphenyl)-2-oxo-pyrrolidin-3-yl]acetyl]amino]butanoic acid CAS Name: 3-[[2-[1-(4-carbamimidoylphenyl)-2-oxo-3-pyrrolidinyl]-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-[[2-[1-(4-carbamimidoylphenyl)-2-oxopyrrolidin-3-yl]acetyl]amino]butanoic acid Traditional Name: 3-[[2-[1-(4-amidinophenyl)-2-keto-pyrrolidin-3-yl]acetyl]amino]butyric acid Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)CC1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(CC(=O)O)NC(=O)CC1CCN(C1=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H22N4O4/c1-10(8-15(23)24)20-14(22)9-12-6-7-21(17(12)25)13-4-2-11(3-5-13)16(18)19/h2-5,10,12H,6-9H2,1H3,(H3,18,19)(H,20,22)(H,23,24)