(3-azanyl-3-oxidanylidene-propyl) 4-propoxybenzoate

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl) 4-propoxybenzoate Openeye Name: (3-amino-3-oxo-propyl) 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid (3-amino-3-oxopropyl) ester IUPAC Name: (3-amino-3-oxopropyl) 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid (3-amino-3-keto-propyl) ester Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OCCC(=O)N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OCCC(=O)N

InChI

InChI=1S/C13H17NO4/c1-2-8-17-11-5-3-10(4-6-11)13(16)18-9-7-12(14)15/h3-6H,2,7-9H2,1H3,(H2,14,15)