N-[di(propan-2-yloxy)phosphoryl-(2-methoxyphenyl)methyl]-4-methyl-3-nitro-aniline

Systemtic Name: N-[di(propan-2-yloxy)phosphoryl-(2-methoxyphenyl)methyl]-4-methyl-3-nitro-aniline Openeye Name: N-[diisopropoxyphosphoryl-(2-methoxyphenyl)methyl]-4-methyl-3-nitro-aniline CAS Name: N-[di(propan-2-yloxy)phosphoryl-(2-methoxyphenyl)methyl]-4-methyl-3-nitroaniline IUPAC Name: N-[di(propan-2-yloxy)phosphoryl-(2-methoxyphenyl)methyl]-4-methyl-3-nitroaniline Traditional Name: [diisopropoxyphosphoryl-(2-methoxyphenyl)methyl]-(4-methyl-3-nitro-phenyl)amine Formula: C21H29N2O6P MolecularWeight: 436.438521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(C2=CC=CC=C2OC)P(=O)(OC(C)C)OC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(C2=CC=CC=C2OC)P(=O)(OC(C)C)OC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H29N2O6P/c1-14(2)28-30(26,29-15(3)4)21(18-9-7-8-10-20(18)27-6)22-17-12-11-16(5)19(13-17)23(24)25/h7-15,21-22H,1-6H3