2-[1-[4-(4-carbamimidoylphenyl)-4-oxidanylidene-butanoyl]piperidin-4-yl]oxyethanoic acid

Systemtic Name: 2-[1-[4-(4-carbamimidoylphenyl)-4-oxidanylidene-butanoyl]piperidin-4-yl]oxyethanoic acid Openeye Name: 2-[[1-[4-(4-carbamimidoylphenyl)-4-oxo-butanoyl]-4-piperidyl]oxy]acetic acid CAS Name: 2-[[1-[4-(4-carbamimidoylphenyl)-1,4-dioxobutyl]-4-piperidinyl]oxy]acetic acid IUPAC Name: 2-[1-[4-(4-carbamimidoylphenyl)-4-oxobutanoyl]piperidin-4-yl]oxyacetic acid Traditional Name: 2-[[1-[4-(4-amidinophenyl)-4-keto-butanoyl]-4-piperidyl]oxy]acetic acid Formula: C18H23N3O5 MolecularWeight: 361.39232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC(=O)O)C(=O)CCC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

C1CN(CCC1OCC(=O)O)C(=O)CCC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H23N3O5/c19-18(20)13-3-1-12(2-4-13)15(22)5-6-16(23)21-9-7-14(8-10-21)26-11-17(24)25/h1-4,14H,5-11H2,(H3,19,20)(H,24,25)