3-(1-azanylpropan-2-yl)-1-methyl-cyclohexa-2,4-diene-1-carboxylic acid

Systemtic Name: 3-(1-azanylpropan-2-yl)-1-methyl-cyclohexa-2,4-diene-1-carboxylic acid Openeye Name: 3-(2-amino-1-methyl-ethyl)-1-methyl-cyclohexa-2,4-diene-1-carboxylic acid CAS Name: 3-(1-aminopropan-2-yl)-1-methyl-1-cyclohexa-2,4-dienecarboxylic acid IUPAC Name: 3-(1-aminopropan-2-yl)-1-methylcyclohexa-2,4-diene-1-carboxylic acid Traditional Name: 3-(2-amino-1-methyl-ethyl)-1-methyl-cyclohexa-2,4-diene-1-carboxylic acid Formula: C11H17NO2 MolecularWeight: 195.25818

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)C1=CC(CC=C1)(C)C(=O)O

Isomeric SMILES

CC(CN)C1=CC(CC=C1)(C)C(=O)O

InChI

InChI=1S/C11H17NO2/c1-8(7-12)9-4-3-5-11(2,6-9)10(13)14/h3-4,6,8H,5,7,12H2,1-2H3,(H,13,14)