methyl 4-[(2R)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]oxy-3-nitro-benzoate

Systemtic Name: methyl 4-[(2R)-1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl]oxy-3-nitro-benzoate Openeye Name: methyl 4-[(1R)-1-methyl-2-(2-naphthylamino)-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[(2R)-1-(2-naphthalenylamino)-1-oxopropan-2-yl]oxy-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[(2R)-1-(naphthalen-2-ylamino)-1-oxopropan-2-yl]oxy-3-nitrobenzoate Traditional Name: 4-[(1R)-2-keto-1-methyl-2-(2-naphthylamino)ethoxy]-3-nitro-benzoic acid methyl ester Formula: C21H18N2O6 MolecularWeight: 394.37742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=CC=CC=C2C=C1)OC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O6/c1-13(20(24)22-17-9-7-14-5-3-4-6-15(14)11-17)29-19-10-8-16(21(25)28-2)12-18(19)23(26)27/h3-13H,1-2H3,(H,22,24)/t13-/m1/s1