4,6-dimethyl-5-nitro-N1,N3-bis(triphenylmethyl)benzene-1,3-diamine

Systemtic Name: 4,6-dimethyl-5-nitro-N1,N3-bis(triphenylmethyl)benzene-1,3-diamine Openeye Name: 4,6-dimethyl-5-nitro-N1,N3-ditrityl-benzene-1,3-diamine CAS Name: 4,6-dimethyl-5-nitro-N1,N3-bis(triphenylmethyl)benzene-1,3-diamine IUPAC Name: 4,6-dimethyl-5-nitro-1-N,3-N-ditritylbenzene-1,3-diamine Traditional Name: [2,4-dimethyl-3-nitro-5-(tritylamino)phenyl]-trityl-amine Formula: C46H39N3O2 MolecularWeight: 665.82076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C)[N+](=O)[O-]

InChI

InChI=1S/C46H39N3O2/c1-34-42(47-45(36-21-9-3-10-22-36,37-23-11-4-12-24-37)38-25-13-5-14-26-38)33-43(35(2)44(34)49(50)51)48-46(39-27-15-6-16-28-39,40-29-17-7-18-30-40)41-31-19-8-20-32-41/h3-33,47-48H,1-2H3