ethyl 4-[[di(propan-2-yloxy)phosphoryl-(3-nitrophenyl)methyl]amino]benzoate

Systemtic Name: ethyl 4-[[di(propan-2-yloxy)phosphoryl-(3-nitrophenyl)methyl]amino]benzoate Openeye Name: ethyl 4-[[diisopropoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoate CAS Name: 4-[[di(propan-2-yloxy)phosphoryl-(3-nitrophenyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[di(propan-2-yloxy)phosphoryl-(3-nitrophenyl)methyl]amino]benzoate Traditional Name: 4-[[diisopropoxyphosphoryl-(3-nitrophenyl)methyl]amino]benzoic acid ethyl ester Formula: C22H29N2O7P MolecularWeight: 464.448621

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N2O7P/c1-6-29-22(25)17-10-12-19(13-11-17)23-21(18-8-7-9-20(14-18)24(26)27)32(28,30-15(2)3)31-16(4)5/h7-16,21,23H,6H2,1-5H3