methyl 3-[4-acetyloxy-3-(3-methoxy-3-oxidanylidene-propyl)phenyl]-2-azanyl-propanoate

Systemtic Name: methyl 3-[4-acetyloxy-3-(3-methoxy-3-oxidanylidene-propyl)phenyl]-2-azanyl-propanoate Openeye Name: methyl 3-[4-acetoxy-3-(3-methoxy-3-oxo-propyl)phenyl]-2-amino-propanoate CAS Name: 3-[4-acetyloxy-3-(3-methoxy-3-oxopropyl)phenyl]-2-aminopropanoic acid methyl ester IUPAC Name: methyl 3-[4-acetyloxy-3-(3-methoxy-3-oxopropyl)phenyl]-2-aminopropanoate Traditional Name: 3-[4-acetoxy-3-(3-keto-3-methoxy-propyl)phenyl]-2-amino-propionic acid methyl ester Formula: C16H21NO6 MolecularWeight: 323.34104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)OC)N)CCC(=O)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)OC)N)CCC(=O)OC

InChI

InChI=1S/C16H21NO6/c1-10(18)23-14-6-4-11(9-13(17)16(20)22-3)8-12(14)5-7-15(19)21-2/h4,6,8,13H,5,7,9,17H2,1-3H3