2-[[5-carbamimidoyl-2-[[(3-chlorophenyl)carbonylamino]methyl]phenyl]amino]ethanoic acid

Systemtic Name: 2-[[5-carbamimidoyl-2-[[(3-chlorophenyl)carbonylamino]methyl]phenyl]amino]ethanoic acid Openeye Name: 2-[5-carbamimidoyl-2-[[(3-chlorobenzoyl)amino]methyl]anilino]acetic acid CAS Name: 2-[5-carbamimidoyl-2-[[[(3-chlorophenyl)-oxomethyl]amino]methyl]anilino]acetic acid IUPAC Name: 2-[5-carbamimidoyl-2-[[(3-chlorobenzoyl)amino]methyl]anilino]acetic acid Traditional Name: 2-[5-amidino-2-[[(3-chlorobenzoyl)amino]methyl]anilino]acetic acid Formula: C17H17ClN4O3 MolecularWeight: 360.79488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)O

InChI

InChI=1S/C17H17ClN4O3/c18-13-3-1-2-11(6-13)17(25)22-8-12-5-4-10(16(19)20)7-14(12)21-9-15(23)24/h1-7,21H,8-9H2,(H3,19,20)(H,22,25)(H,23,24)