2-[5-[[[1-(4-carbamimidoylphenyl)piperidin-4-yl]amino]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[5-[[[1-(4-carbamimidoylphenyl)piperidin-4-yl]amino]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[5-[[[1-(4-carbamimidoylphenyl)-4-piperidyl]amino]methyl]-2-oxo-pyrrolidin-3-yl]acetic acid CAS Name: 2-[5-[[[1-(4-carbamimidoylphenyl)-4-piperidinyl]amino]methyl]-2-oxo-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[5-[[[1-(4-carbamimidoylphenyl)piperidin-4-yl]amino]methyl]-2-oxopyrrolidin-3-yl]acetic acid Traditional Name: 2-[5-[[[1-(4-amidinophenyl)-4-piperidyl]amino]methyl]-2-keto-pyrrolidin-3-yl]acetic acid Formula: C19H27N5O3 MolecularWeight: 373.44938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC2CC(C(=O)N2)CC(=O)O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CN(CCC1NCC2CC(C(=O)N2)CC(=O)O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H27N5O3/c20-18(21)12-1-3-16(4-2-12)24-7-5-14(6-8-24)22-11-15-9-13(10-17(25)26)19(27)23-15/h1-4,13-15,22H,5-11H2,(H3,20,21)(H,23,27)(H,25,26)