methyl 4-(1-azanyl-3-methoxy-3-oxidanylidene-propyl)benzoate

Systemtic Name: methyl 4-(1-azanyl-3-methoxy-3-oxidanylidene-propyl)benzoate Openeye Name: methyl 4-(1-amino-3-methoxy-3-oxo-propyl)benzoate CAS Name: 4-(1-amino-3-methoxy-3-oxopropyl)benzoic acid methyl ester IUPAC Name: methyl 4-(1-amino-3-methoxy-3-oxopropyl)benzoate Traditional Name: 4-(1-amino-3-keto-3-methoxy-propyl)benzoic acid methyl ester Formula: C12H15NO4 MolecularWeight: 237.2518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)C(=O)OC)N

Isomeric SMILES

COC(=O)CC(C1=CC=C(C=C1)C(=O)OC)N

InChI

InChI=1S/C12H15NO4/c1-16-11(14)7-10(13)8-3-5-9(6-4-8)12(15)17-2/h3-6,10H,7,13H2,1-2H3