N-[(3,5-dimethoxyphenyl)methyl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-3-(2-nitroanilino)propanamide CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-3-(2-nitroanilino)propanamide Traditional Name: N-(3,5-dimethoxybenzyl)-3-(2-nitroanilino)propionamide Formula: C18H21N3O5 MolecularWeight: 359.37644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC(=O)CCNC2=CC=CC=C2[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC(=O)CCNC2=CC=CC=C2[N+](=O)[O-])OC

InChI

InChI=1S/C18H21N3O5/c1-25-14-9-13(10-15(11-14)26-2)12-20-18(22)7-8-19-16-5-3-4-6-17(16)21(23)24/h3-6,9-11,19H,7-8,12H2,1-2H3,(H,20,22)