N1,N4-bis[bis(2,4-dimethylphenoxy)phosphoryl]piperazine-1,4-diamine

Systemtic Name: N1,N4-bis[bis(2,4-dimethylphenoxy)phosphoryl]piperazine-1,4-diamine Openeye Name: N1,N4-bis[bis(2,4-dimethylphenoxy)phosphoryl]piperazine-1,4-diamine CAS Name: N1,N4-bis[bis(2,4-dimethylphenoxy)phosphoryl]piperazine-1,4-diamine IUPAC Name: 1-N,4-N-bis[bis(2,4-dimethylphenoxy)phosphoryl]piperazine-1,4-diamine Traditional Name: bis(2,4-dimethylphenoxy)phosphoryl-[4-[bis(2,4-dimethylphenoxy)phosphorylamino]piperazino]amine Formula: C36H46N4O6P2 MolecularWeight: 692.721162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OP(=O)(NN2CCN(CC2)NP(=O)(OC3=C(C=C(C=C3)C)C)OC4=C(C=C(C=C4)C)C)OC5=C(C=C(C=C5)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OP(=O)(NN2CCN(CC2)NP(=O)(OC3=C(C=C(C=C3)C)C)OC4=C(C=C(C=C4)C)C)OC5=C(C=C(C=C5)C)C)C

InChI

InChI=1S/C36H46N4O6P2/c1-25-9-13-33(29(5)21-25)43-47(41,44-34-14-10-26(2)22-30(34)6)37-39-17-19-40(20-18-39)38-48(42,45-35-15-11-27(3)23-31(35)7)46-36-16-12-28(4)24-32(36)8/h9-16,21-24H,17-20H2,1-8H3,(H,37,41)(H,38,42)