4-[(E)-3-(4-carbamimidoylphenoxy)-2-methyl-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-3-(4-carbamimidoylphenoxy)-2-methyl-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 4-[(E)-3-(4-carbamimidoylphenoxy)-2-methyl-3-oxo-prop-1-enyl]benzoic acid CAS Name: 4-[(E)-3-(4-carbamimidoylphenoxy)-2-methyl-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 4-[(E)-3-(4-carbamimidoylphenoxy)-2-methyl-3-oxoprop-1-enyl]benzoic acid Traditional Name: 4-[(E)-3-(4-amidinophenoxy)-3-keto-2-methyl-prop-1-enyl]benzoic acid Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O4/c1-11(10-12-2-4-14(5-3-12)17(21)22)18(23)24-15-8-6-13(7-9-15)16(19)20/h2-10H,1H3,(H3,19,20)(H,21,22)/b11-10+