methyl 4-acetamido-5-chloranyl-3-cyclohex-3-en-1-yl-2-oxidanyl-benzoate

Systemtic Name: methyl 4-acetamido-5-chloranyl-3-cyclohex-3-en-1-yl-2-oxidanyl-benzoate Openeye Name: methyl 4-acetamido-5-chloro-3-cyclohex-3-en-1-yl-2-hydroxy-benzoate CAS Name: 4-acetamido-5-chloro-3-(1-cyclohex-3-enyl)-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-acetamido-5-chloro-3-cyclohex-3-en-1-yl-2-hydroxybenzoate Traditional Name: 4-acetamido-5-chloro-3-cyclohex-3-en-1-yl-2-hydroxy-benzoic acid methyl ester Formula: C16H18ClNO4 MolecularWeight: 323.77142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1C2CCC=CC2)O)C(=O)OC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1C2CCC=CC2)O)C(=O)OC)Cl

InChI

InChI=1S/C16H18ClNO4/c1-9(19)18-14-12(17)8-11(16(21)22-2)15(20)13(14)10-6-4-3-5-7-10/h3-4,8,10,20H,5-7H2,1-2H3,(H,18,19)