2-[2-[1-[(4-carbamimidoylphenyl)amino]-2-methoxy-2-oxidanylidene-ethyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[1-[(4-carbamimidoylphenyl)amino]-2-methoxy-2-oxidanylidene-ethyl]phenyl]benzoic acid Openeye Name: 2-[2-[1-(4-carbamimidoylanilino)-2-methoxy-2-oxo-ethyl]phenyl]benzoic acid CAS Name: 2-[2-[1-(4-carbamimidoylanilino)-2-methoxy-2-oxoethyl]phenyl]benzoic acid IUPAC Name: 2-[2-[1-(4-carbamimidoylanilino)-2-methoxy-2-oxoethyl]phenyl]benzoic acid Traditional Name: 2-[2-[1-(4-amidinoanilino)-2-keto-2-methoxy-ethyl]phenyl]benzoic acid Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1C2=CC=CC=C2C(=O)O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1C2=CC=CC=C2C(=O)O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H21N3O4/c1-30-23(29)20(26-15-12-10-14(11-13-15)21(24)25)18-8-4-2-6-16(18)17-7-3-5-9-19(17)22(27)28/h2-13,20,26H,1H3,(H3,24,25)(H,27,28)