2-[1-[4-(4-carbamimidoylphenyl)phenyl]carbonylpiperidin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[4-(4-carbamimidoylphenyl)phenyl]carbonylpiperidin-4-yl]ethanoic acid Openeye Name: 2-[1-[4-(4-carbamimidoylphenyl)benzoyl]-4-piperidyl]acetic acid CAS Name: 2-[1-[[4-(4-carbamimidoylphenyl)phenyl]-oxomethyl]-4-piperidinyl]acetic acid IUPAC Name: 2-[1-[4-(4-carbamimidoylphenyl)benzoyl]piperidin-4-yl]acetic acid Traditional Name: 2-[1-[4-(4-amidinophenyl)benzoyl]-4-piperidyl]acetic acid Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC(=O)O)C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CN(CCC1CC(=O)O)C(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H23N3O3/c22-20(23)17-5-1-15(2-6-17)16-3-7-18(8-4-16)21(27)24-11-9-14(10-12-24)13-19(25)26/h1-8,14H,9-13H2,(H3,22,23)(H,25,26)