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

Systemtic Name: 2-[2-[3-[(4-carbamimidoylphenyl)amino]-3-oxidanylidene-propyl]piperidin-1-yl]ethanoic acid Openeye Name: 2-[2-[3-(4-carbamimidoylanilino)-3-oxo-propyl]-1-piperidyl]acetic acid CAS Name: 2-[2-[3-(4-carbamimidoylanilino)-3-oxopropyl]-1-piperidinyl]acetic acid IUPAC Name: 2-[2-[3-(4-carbamimidoylanilino)-3-oxopropyl]piperidin-1-yl]acetic acid Traditional Name: 2-[2-[3-(4-amidinoanilino)-3-keto-propyl]piperidino]acetic acid Formula: C17H24N4O3 MolecularWeight: 332.39746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCC(=O)NC2=CC=C(C=C2)C(=N)N)CC(=O)O

Isomeric SMILES

C1CCN(C(C1)CCC(=O)NC2=CC=C(C=C2)C(=N)N)CC(=O)O

InChI

InChI=1S/C17H24N4O3/c18-17(19)12-4-6-13(7-5-12)20-15(22)9-8-14-3-1-2-10-21(14)11-16(23)24/h4-7,14H,1-3,8-11H2,(H3,18,19)(H,20,22)(H,23,24)