4-azanyl-1-ethyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 4-azanyl-1-ethyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 4-amino-1-ethyl-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 4-amino-1-ethyl-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 4-amino-1-ethylcyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 4-amino-1-ethyl-cyclohexa-2,4-diene-1-carboxylic acid Formula: C9H13NO2 MolecularWeight: 167.20502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC=C(C=C1)N)C(=O)O

Isomeric SMILES

CCC1(CC=C(C=C1)N)C(=O)O

InChI

InChI=1S/C9H13NO2/c1-2-9(8(11)12)5-3-7(10)4-6-9/h3-5H,2,6,10H2,1H3,(H,11,12)