methyl 4-azanyl-3-(3-cyanopropoxy)benzoate

Systemtic Name: methyl 4-azanyl-3-(3-cyanopropoxy)benzoate Openeye Name: methyl 4-amino-3-(3-cyanopropoxy)benzoate CAS Name: 4-amino-3-(3-cyanopropoxy)benzoic acid methyl ester IUPAC Name: methyl 4-amino-3-(3-cyanopropoxy)benzoate Traditional Name: 4-amino-3-(3-cyanopropoxy)benzoic acid methyl ester Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N)OCCCC#N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N)OCCCC#N

InChI

InChI=1S/C12H14N2O3/c1-16-12(15)9-4-5-10(14)11(8-9)17-7-3-2-6-13/h4-5,8H,2-3,7,14H2,1H3