methyl 2-ethanoyl-3-(1-nitronaphthalen-2-yl)butanoate

Systemtic Name: methyl 2-ethanoyl-3-(1-nitronaphthalen-2-yl)butanoate Openeye Name: methyl 2-acetyl-3-(1-nitro-2-naphthyl)butanoate CAS Name: 2-acetyl-3-(1-nitro-2-naphthalenyl)butanoic acid methyl ester IUPAC Name: methyl 2-acetyl-3-(1-nitronaphthalen-2-yl)butanoate Traditional Name: 2-acetyl-3-(1-nitro-2-naphthyl)butyric acid methyl ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-])C(C(=O)C)C(=O)OC

Isomeric SMILES

CC(C1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-])C(C(=O)C)C(=O)OC

InChI

InChI=1S/C17H17NO5/c1-10(15(11(2)19)17(20)23-3)13-9-8-12-6-4-5-7-14(12)16(13)18(21)22/h4-10,15H,1-3H3