2-[1-[2-(6-carbamimidoyl-3-oxidanylidene-1H-isoindol-2-yl)ethanoyl]piperidin-4-yl]oxyethanoic acid

Systemtic Name: 2-[1-[2-(6-carbamimidoyl-3-oxidanylidene-1H-isoindol-2-yl)ethanoyl]piperidin-4-yl]oxyethanoic acid Openeye Name: 2-[[1-[2-(5-carbamimidoyl-1-oxo-isoindolin-2-yl)acetyl]-4-piperidyl]oxy]acetic acid CAS Name: 2-[[1-[2-(6-carbamimidoyl-3-oxo-1H-isoindol-2-yl)-1-oxoethyl]-4-piperidinyl]oxy]acetic acid IUPAC Name: 2-[1-[2-(6-carbamimidoyl-3-oxo-1H-isoindol-2-yl)acetyl]piperidin-4-yl]oxyacetic acid Traditional Name: 2-[[1-[2-(5-amidino-1-keto-isoindolin-2-yl)acetyl]-4-piperidyl]oxy]acetic acid Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC(=O)O)C(=O)CN2CC3=C(C2=O)C=CC(=C3)C(=N)N

Isomeric SMILES

C1CN(CCC1OCC(=O)O)C(=O)CN2CC3=C(C2=O)C=CC(=C3)C(=N)N

InChI

InChI=1S/C18H22N4O5/c19-17(20)11-1-2-14-12(7-11)8-22(18(14)26)9-15(23)21-5-3-13(4-6-21)27-10-16(24)25/h1-2,7,13H,3-6,8-10H2,(H3,19,20)(H,24,25)