4-(4-aminophenyl)carbonyl-1-(4-ethoxy-4-oxidanylidene-butyl)pyrrole-3-carboxylic acid

Systemtic Name: 4-(4-aminophenyl)carbonyl-1-(4-ethoxy-4-oxidanylidene-butyl)pyrrole-3-carboxylic acid Openeye Name: 4-(4-aminobenzoyl)-1-(4-ethoxy-4-oxo-butyl)pyrrole-3-carboxylic acid CAS Name: 4-[(4-aminophenyl)-oxomethyl]-1-(4-ethoxy-4-oxobutyl)-3-pyrrolecarboxylic acid IUPAC Name: 4-(4-aminobenzoyl)-1-(4-ethoxy-4-oxobutyl)pyrrole-3-carboxylic acid Traditional Name: 4-(4-aminobenzoyl)-1-(4-ethoxy-4-keto-butyl)pyrrole-3-carboxylic acid Formula: C18H20N2O5 MolecularWeight: 344.3618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C(=C1)C(=O)O)C(=O)C2=CC=C(C=C2)N

Isomeric SMILES

CCOC(=O)CCCN1C=C(C(=C1)C(=O)O)C(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C18H20N2O5/c1-2-25-16(21)4-3-9-20-10-14(15(11-20)18(23)24)17(22)12-5-7-13(19)8-6-12/h5-8,10-11H,2-4,9,19H2,1H3,(H,23,24)