methyl 2-azanyl-3-(2-oxidanylidenepentyl)benzoate

Systemtic Name: methyl 2-azanyl-3-(2-oxidanylidenepentyl)benzoate Openeye Name: methyl 2-amino-3-(2-oxopentyl)benzoate CAS Name: 2-amino-3-(2-oxopentyl)benzoic acid methyl ester IUPAC Name: methyl 2-amino-3-(2-oxopentyl)benzoate Traditional Name: 2-amino-3-(2-ketopentyl)benzoic acid methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)CC1=CC=CC(=C1N)C(=O)OC

Isomeric SMILES

CCCC(=O)CC1=CC=CC(=C1N)C(=O)OC

InChI

InChI=1S/C13H17NO3/c1-3-5-10(15)8-9-6-4-7-11(12(9)14)13(16)17-2/h4,6-7H,3,5,8,14H2,1-2H3