azane; 3-pentan-2-ylbenzoic acid

Systemtic Name: azane; 3-pentan-2-ylbenzoic acid Openeye Name: ammonia; 3-(1-methylbutyl)benzoic acid CAS Name: ammonia; 3-pentan-2-ylbenzoic acid IUPAC Name: azane; 3-pentan-2-ylbenzoic acid Traditional Name: ammonia; 3-(1-methylbutyl)benzoic acid Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC=CC(=C1)C(=O)O.N

Isomeric SMILES

CCCC(C)C1=CC=CC(=C1)C(=O)O.N

InChI

InChI=1S/C12H16O2.H3N/c1-3-5-9(2)10-6-4-7-11(8-10)12(13)14;/h4,6-9H,3,5H2,1-2H3,(H,13,14);1H3