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

Systemtic Name: 2-[3-[3-[(4-carbamimidoylphenyl)amino]-3-oxidanylidene-propyl]-2-oxidanylidene-piperidin-1-yl]ethanoic acid Openeye Name: 2-[3-[3-(4-carbamimidoylanilino)-3-oxo-propyl]-2-oxo-1-piperidyl]acetic acid CAS Name: 2-[3-[3-(4-carbamimidoylanilino)-3-oxopropyl]-2-oxo-1-piperidinyl]acetic acid IUPAC Name: 2-[3-[3-(4-carbamimidoylanilino)-3-oxopropyl]-2-oxopiperidin-1-yl]acetic acid Traditional Name: 2-[3-[3-(4-amidinoanilino)-3-keto-propyl]-2-keto-piperidino]acetic acid Formula: C17H22N4O4 MolecularWeight: 346.38098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)CC(=O)O)CCC(=O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1CC(C(=O)N(C1)CC(=O)O)CCC(=O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H22N4O4/c18-16(19)11-3-6-13(7-4-11)20-14(22)8-5-12-2-1-9-21(17(12)25)10-15(23)24/h3-4,6-7,12H,1-2,5,8-10H2,(H3,18,19)(H,20,22)(H,23,24)