[2-[(6-methoxynaphthalen-2-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [2-[(6-methoxynaphthalen-2-yl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate Openeye Name: [2-[(6-methoxy-2-naphthyl)methyl-methyl-amino]-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [2-[(6-methoxy-2-naphthalenyl)methyl-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-2-oxoethyl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [2-keto-2-[(6-methoxy-2-naphthyl)methyl-methyl-amino]ethyl] ester Formula: C20H18N2O6S MolecularWeight: 414.43172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)COC(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)COC(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O6S/c1-21(11-13-3-4-15-10-16(27-2)6-5-14(15)9-13)18(23)12-28-20(24)17-7-8-19(29-17)22(25)26/h3-10H,11-12H2,1-2H3