2-[[5-carbamimidoyl-2-[[(3,4-dimethylphenyl)carbonylamino]methyl]phenyl]amino]ethanoic acid

Systemtic Name: 2-[[5-carbamimidoyl-2-[[(3,4-dimethylphenyl)carbonylamino]methyl]phenyl]amino]ethanoic acid Openeye Name: 2-[5-carbamimidoyl-2-[[(3,4-dimethylbenzoyl)amino]methyl]anilino]acetic acid CAS Name: 2-[5-carbamimidoyl-2-[[[(3,4-dimethylphenyl)-oxomethyl]amino]methyl]anilino]acetic acid IUPAC Name: 2-[5-carbamimidoyl-2-[[(3,4-dimethylbenzoyl)amino]methyl]anilino]acetic acid Traditional Name: 2-[5-amidino-2-[[(3,4-dimethylbenzoyl)amino]methyl]anilino]acetic acid Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)O)C

InChI

InChI=1S/C19H22N4O3/c1-11-3-4-14(7-12(11)2)19(26)23-9-15-6-5-13(18(20)21)8-16(15)22-10-17(24)25/h3-8,22H,9-10H2,1-2H3,(H3,20,21)(H,23,26)(H,24,25)