[5-methoxy-2-nitro-4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]phenyl]methyl ethanoate

Systemtic Name: [5-methoxy-2-nitro-4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]phenyl]methyl ethanoate Openeye Name: [4-[2-(benzylamino)-2-oxo-ethoxy]-5-methoxy-2-nitro-phenyl]methyl acetate CAS Name: acetic acid [5-methoxy-2-nitro-4-[2-oxo-2-[(phenylmethyl)amino]ethoxy]phenyl]methyl ester IUPAC Name: [4-[2-(benzylamino)-2-oxoethoxy]-5-methoxy-2-nitrophenyl]methyl acetate Traditional Name: acetic acid [4-[2-(benzylamino)-2-keto-ethoxy]-5-methoxy-2-nitro-benzyl] ester Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC(=C(C=C1[N+](=O)[O-])OCC(=O)NCC2=CC=CC=C2)OC

Isomeric SMILES

CC(=O)OCC1=CC(=C(C=C1[N+](=O)[O-])OCC(=O)NCC2=CC=CC=C2)OC

InChI

InChI=1S/C19H20N2O7/c1-13(22)27-11-15-8-17(26-2)18(9-16(15)21(24)25)28-12-19(23)20-10-14-6-4-3-5-7-14/h3-9H,10-12H2,1-2H3,(H,20,23)