methyl 4-[4-aminocarbonyl-2,5-dimethyl-1-(3-oxidanylpropyl)pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-2,5-dimethyl-1-(3-oxidanylpropyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-[4-carbamoyl-1-(3-hydroxypropyl)-2,5-dimethyl-pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-1-(3-hydroxypropyl)-2,5-dimethyl-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-1-(3-hydroxypropyl)-2,5-dimethylpyrrol-3-yl]benzoate Traditional Name: 4-[4-carbamoyl-1-(3-hydroxypropyl)-2,5-dimethyl-pyrrol-3-yl]benzoic acid methyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCCO)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(N1CCCO)C)C(=O)N)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H22N2O4/c1-11-15(13-5-7-14(8-6-13)18(23)24-3)16(17(19)22)12(2)20(11)9-4-10-21/h5-8,21H,4,9-10H2,1-3H3,(H2,19,22)