[2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-5-methoxy-4-(3-methylbutoxy)benzoate

Systemtic Name: [2-[(4-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-5-methoxy-4-(3-methylbutoxy)benzoate Openeye Name: [2-(4-carbamoylanilino)-2-oxo-ethyl] 3-chloro-4-isopentyloxy-5-methoxy-benzoate CAS Name: 3-chloro-5-methoxy-4-(3-methylbutoxy)benzoic acid [2-(4-carbamoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-carbamoylanilino)-2-oxoethyl] 3-chloro-5-methoxy-4-(3-methylbutoxy)benzoate Traditional Name: 3-chloro-4-isoamoxy-5-methoxy-benzoic acid [2-(4-carbamoylanilino)-2-keto-ethyl] ester Formula: C22H25ClN2O6 MolecularWeight: 448.8967

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)N)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)N)OC

InChI

InChI=1S/C22H25ClN2O6/c1-13(2)8-9-30-20-17(23)10-15(11-18(20)29-3)22(28)31-12-19(26)25-16-6-4-14(5-7-16)21(24)27/h4-7,10-11,13H,8-9,12H2,1-3H3,(H2,24,27)(H,25,26)