4-azanyl-1-butyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-azanyl-1-butyl-pyrrole-2-carboxylic acid Openeye Name: 4-amino-1-butyl-pyrrole-2-carboxylic acid CAS Name: 4-amino-1-butyl-2-pyrrolecarboxylic acid IUPAC Name: 4-amino-1-butylpyrrole-2-carboxylic acid Traditional Name: 4-amino-1-butyl-pyrrole-2-carboxylic acid Formula: C9H14N2O2 MolecularWeight: 182.21966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C=C1C(=O)O)N

Isomeric SMILES

CCCCN1C=C(C=C1C(=O)O)N

InChI

InChI=1S/C9H14N2O2/c1-2-3-4-11-6-7(10)5-8(11)9(12)13/h5-6H,2-4,10H2,1H3,(H,12,13)