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

Systemtic Name: N-[[cyclohexyloxy-(4-dimethylaminophenyl)phosphoryl]-phenyl-methyl]-2-nitro-aniline Openeye Name: N-[[cyclohexoxy-(4-dimethylaminophenyl)phosphoryl]-phenyl-methyl]-2-nitro-aniline CAS Name: N-[[cyclohexyloxy-(4-dimethylaminophenyl)phosphoryl]-phenylmethyl]-2-nitroaniline IUPAC Name: N-[[cyclohexyloxy-(4-dimethylaminophenyl)phosphoryl]-phenylmethyl]-2-nitroaniline Traditional Name: [4-[cyclohexoxy-[(2-nitroanilino)-phenyl-methyl]phosphoryl]phenyl]-dimethyl-amine Formula: C27H32N3O4P MolecularWeight: 493.534441

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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-])OC4CCCCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)P(=O)(C(C2=CC=CC=C2)NC3=CC=CC=C3[N+](=O)[O-])OC4CCCCC4

InChI

InChI=1S/C27H32N3O4P/c1-29(2)22-17-19-24(20-18-22)35(33,34-23-13-7-4-8-14-23)27(21-11-5-3-6-12-21)28-25-15-9-10-16-26(25)30(31)32/h3,5-6,9-12,15-20,23,27-28H,4,7-8,13-14H2,1-2H3