pentyl 4-azanyl-2,3-dimethyl-benzoate

Systemtic Name: pentyl 4-azanyl-2,3-dimethyl-benzoate Openeye Name: pentyl 4-amino-2,3-dimethyl-benzoate CAS Name: 4-amino-2,3-dimethylbenzoic acid pentyl ester IUPAC Name: pentyl 4-amino-2,3-dimethylbenzoate Traditional Name: 4-amino-2,3-dimethyl-benzoic acid amyl ester Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C(=C(C=C1)N)C)C

Isomeric SMILES

CCCCCOC(=O)C1=C(C(=C(C=C1)N)C)C

InChI

InChI=1S/C14H21NO2/c1-4-5-6-9-17-14(16)12-7-8-13(15)11(3)10(12)2/h7-8H,4-6,9,15H2,1-3H3