[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-oxidanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-oxidanylbenzoate Openeye Name: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-hydroxybenzoate CAS Name: 3-hydroxybenzoic acid [2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl] ester IUPAC Name: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] 3-hydroxybenzoate Traditional Name: 3-hydroxybenzoic acid [2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] ester Formula: C16H17NO4 MolecularWeight: 287.31048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)COC(=O)C2=CC(=CC=C2)O

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)COC(=O)C2=CC(=CC=C2)O

InChI

InChI=1S/C16H17NO4/c1-10-7-14(11(2)17(10)3)15(19)9-21-16(20)12-5-4-6-13(18)8-12/h4-8,18H,9H2,1-3H3