4-[[(Z)-(4-methoxycarbonyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]amino]benzoic acid

Systemtic Name: 4-[[(Z)-(4-methoxycarbonyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]amino]benzoic acid Openeye Name: 4-[[(Z)-(4-methoxycarbonyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]amino]benzoic acid CAS Name: 4-[[(Z)-(4-methoxycarbonyl-3,5-dimethyl-2-pyrrolylidene)methyl]amino]benzoic acid IUPAC Name: 4-[[(Z)-(4-methoxycarbonyl-3,5-dimethylpyrrol-2-ylidene)methyl]amino]benzoic acid Traditional Name: 4-[[(Z)-(4-carbomethoxy-3,5-dimethyl-pyrrol-2-ylidene)methyl]amino]benzoic acid Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC1=CNC2=CC=C(C=C2)C(=O)O)C)C(=O)OC

Isomeric SMILES

CC\1=C(C(=N/C1=C\NC2=CC=C(C=C2)C(=O)O)C)C(=O)OC

InChI

InChI=1S/C16H16N2O4/c1-9-13(18-10(2)14(9)16(21)22-3)8-17-12-6-4-11(5-7-12)15(19)20/h4-8,17H,1-3H3,(H,19,20)/b13-8-