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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)O)CCC(=O)NC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1CN(CCC1CC(=O)O)CCC(=O)NC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C17H24N4O3/c18-17(19)13-1-3-14(4-2-13)20-15(22)7-10-21-8-5-12(6-9-21)11-16(23)24/h1-4,12H,5-11H2,(H3,18,19)(H,20,22)(H,23,24)