2-[3-[4-[(4-carbamimidoylphenyl)methyl]piperazin-1-yl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[4-[(4-carbamimidoylphenyl)methyl]piperazin-1-yl]phenyl]ethanoic acid Openeye Name: 2-[3-[4-[(4-carbamimidoylphenyl)methyl]piperazin-1-yl]phenyl]acetic acid CAS Name: 2-[3-[4-[(4-carbamimidoylphenyl)methyl]-1-piperazinyl]phenyl]acetic acid IUPAC Name: 2-[3-[4-[(4-carbamimidoylphenyl)methyl]piperazin-1-yl]phenyl]acetic acid Traditional Name: 2-[3-[4-(4-amidinobenzyl)piperazino]phenyl]acetic acid Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C(=N)N)C3=CC=CC(=C3)CC(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C(=N)N)C3=CC=CC(=C3)CC(=O)O

InChI

InChI=1S/C20H24N4O2/c21-20(22)17-6-4-15(5-7-17)14-23-8-10-24(11-9-23)18-3-1-2-16(12-18)13-19(25)26/h1-7,12H,8-11,13-14H2,(H3,21,22)(H,25,26)