phenacyl 2-azanyl-3-oxidanylidene-nonanoate

Systemtic Name: phenacyl 2-azanyl-3-oxidanylidene-nonanoate Openeye Name: phenacyl 2-amino-3-oxo-nonanoate CAS Name: 2-amino-3-oxononanoic acid phenacyl ester IUPAC Name: phenacyl 2-amino-3-oxononanoate Traditional Name: 2-amino-3-keto-pelargonic acid phenacyl ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C(C(=O)OCC(=O)C1=CC=CC=C1)N

Isomeric SMILES

CCCCCCC(=O)C(C(=O)OCC(=O)C1=CC=CC=C1)N

InChI

InChI=1S/C17H23NO4/c1-2-3-4-8-11-14(19)16(18)17(21)22-12-15(20)13-9-6-5-7-10-13/h5-7,9-10,16H,2-4,8,11-12,18H2,1H3