N-[[(4-dimethylaminophenyl)-phenylmethoxy-phosphoryl]-phenyl-methyl]-2-nitro-aniline

Systemtic Name: N-[[(4-dimethylaminophenyl)-phenylmethoxy-phosphoryl]-phenyl-methyl]-2-nitro-aniline Openeye Name: N-[[benzyloxy-(4-dimethylaminophenyl)phosphoryl]-phenyl-methyl]-2-nitro-aniline CAS Name: N-[[(4-dimethylaminophenyl)-phenylmethoxyphosphoryl]-phenylmethyl]-2-nitroaniline IUPAC Name: N-[[(4-dimethylaminophenyl)-phenylmethoxyphosphoryl]-phenylmethyl]-2-nitroaniline Traditional Name: [4-[benzoxy-[(2-nitroanilino)-phenyl-methyl]phosphoryl]phenyl]-dimethyl-amine Formula: C28H28N3O4P MolecularWeight: 501.513381

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)P(=O)(C(C2=CC=CC=C2)NC3=CC=CC=C3[N+](=O)[O-])OCC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)P(=O)(C(C2=CC=CC=C2)NC3=CC=CC=C3[N+](=O)[O-])OCC4=CC=CC=C4

InChI

InChI=1S/C28H28N3O4P/c1-30(2)24-17-19-25(20-18-24)36(34,35-21-22-11-5-3-6-12-22)28(23-13-7-4-8-14-23)29-26-15-9-10-16-27(26)31(32)33/h3-20,28-29H,21H2,1-2H3