4-[(4-methoxyphenyl)methyl]-N-(2-nitrophenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[(4-methoxyphenyl)methyl]-N-(2-nitrophenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[(4-methoxyphenyl)methyl]-N-(2-nitrophenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[(4-methoxyphenyl)methyl]-N-(2-nitrophenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[(4-methoxyphenyl)methyl]-N-(2-nitrophenyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(2-nitrophenyl)-4-p-anisyl-1,4-diazepane-1-carboxamide Formula: C20H24N4O4 MolecularWeight: 384.42896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4/c1-28-17-9-7-16(8-10-17)15-22-11-4-12-23(14-13-22)20(25)21-18-5-2-3-6-19(18)24(26)27/h2-3,5-10H,4,11-15H2,1H3,(H,21,25)