ethyl 4-[5-oxidanylidene-5-(1,2,5-trimethylpyrrol-3-yl)pentoxy]benzoate

Systemtic Name: ethyl 4-[5-oxidanylidene-5-(1,2,5-trimethylpyrrol-3-yl)pentoxy]benzoate Openeye Name: ethyl 4-[5-oxo-5-(1,2,5-trimethylpyrrol-3-yl)pentoxy]benzoate CAS Name: 4-[5-oxo-5-(1,2,5-trimethyl-3-pyrrolyl)pentoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-oxo-5-(1,2,5-trimethylpyrrol-3-yl)pentoxy]benzoate Traditional Name: 4-[5-keto-5-(1,2,5-trimethylpyrrol-3-yl)pentoxy]benzoic acid ethyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCCCCC(=O)C2=C(N(C(=C2)C)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCCCCC(=O)C2=C(N(C(=C2)C)C)C

InChI

InChI=1S/C21H27NO4/c1-5-25-21(24)17-9-11-18(12-10-17)26-13-7-6-8-20(23)19-14-15(2)22(4)16(19)3/h9-12,14H,5-8,13H2,1-4H3