[2-methyl-4-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethoxy]naphthalen-1-yl] ethanoate

Systemtic Name: [2-methyl-4-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethoxy]naphthalen-1-yl] ethanoate Openeye Name: [2-methyl-4-[2-(3-nitroanilino)-2-oxo-ethoxy]-1-naphthyl] acetate CAS Name: acetic acid [2-methyl-4-[2-(3-nitroanilino)-2-oxoethoxy]-1-naphthalenyl] ester IUPAC Name: [2-methyl-4-[2-(3-nitroanilino)-2-oxoethoxy]naphthalen-1-yl] acetate Traditional Name: acetic acid [4-[2-keto-2-(3-nitroanilino)ethoxy]-2-methyl-1-naphthyl] ester Formula: C21H18N2O6 MolecularWeight: 394.37742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=C1)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC(=O)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2C(=C1)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC(=O)C

InChI

InChI=1S/C21H18N2O6/c1-13-10-19(17-8-3-4-9-18(17)21(13)29-14(2)24)28-12-20(25)22-15-6-5-7-16(11-15)23(26)27/h3-11H,12H2,1-2H3,(H,22,25)