4-chloranyl-3-[2-[(4-ethoxycarbonyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]hydrazinyl]benzoic acid

Systemtic Name: 4-chloranyl-3-[2-[(4-ethoxycarbonyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]hydrazinyl]benzoic acid Openeye Name: 4-chloro-3-[2-[(4-ethoxycarbonyl-3,5-dimethyl-pyrrol-2-ylidene)methyl]hydrazino]benzoic acid CAS Name: 4-chloro-3-[(4-ethoxycarbonyl-3,5-dimethyl-2-pyrrolylidene)methylhydrazo]benzoic acid IUPAC Name: 4-chloro-3-[2-[(4-ethoxycarbonyl-3,5-dimethylpyrrol-2-ylidene)methyl]hydrazinyl]benzoic acid Traditional Name: 3-[N'-[(4-carbethoxy-3,5-dimethyl-pyrrol-2-ylidene)methyl]hydrazino]-4-chloro-benzoic acid Formula: C17H18ClN3O4 MolecularWeight: 363.79552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CNNC2=C(C=CC(=C2)C(=O)O)Cl)N=C1C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CNNC2=C(C=CC(=C2)C(=O)O)Cl)N=C1C)C

InChI

InChI=1S/C17H18ClN3O4/c1-4-25-17(24)15-9(2)14(20-10(15)3)8-19-21-13-7-11(16(22)23)5-6-12(13)18/h5-8,19,21H,4H2,1-3H3,(H,22,23)