(E)-3-[4-(4-carbamimidoylphenoxy)carbonyl-2-methyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(4-carbamimidoylphenoxy)carbonyl-2-methyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(4-carbamimidoylphenoxy)carbonyl-2-methyl-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[(4-carbamimidoylphenoxy)-oxomethyl]-2-methylphenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(4-carbamimidoylphenoxy)carbonyl-2-methylphenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(4-amidinophenoxy)carbonyl-2-methyl-phenyl]acrylic acid Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=N)N)C=CC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=N)N)/C=C/C(=O)O

InChI

InChI=1S/C18H16N2O4/c1-11-10-14(3-2-12(11)6-9-16(21)22)18(23)24-15-7-4-13(5-8-15)17(19)20/h2-10H,1H3,(H3,19,20)(H,21,22)/b9-6+