3,8-bis(3,4-dimethylphenyl)-1,10-dimethyl-11-(2-nitrophenyl)-2,3,8,9-tetrazadispiro[4.0.4^{6}.1^{5}]undeca-1,9-diene-4,7-dione

Systemtic Name: 3,8-bis(3,4-dimethylphenyl)-1,10-dimethyl-11-(2-nitrophenyl)-2,3,8,9-tetrazadispiro[4.0.4^{6}.1^{5}]undeca-1,9-diene-4,7-dione Openeye Name: 3,8-bis(3,4-dimethylphenyl)-1,10-dimethyl-11-(2-nitrophenyl)-2,3,8,9-tetrazadispiro[4.0.4^{6}.1^{5}]undeca-1,9-diene-4,7-dione CAS Name: 3,8-bis(3,4-dimethylphenyl)-1,10-dimethyl-11-(2-nitrophenyl)-2,3,8,9-tetrazadispiro[4.0.4^{6}.1^{5}]undeca-1,9-diene-4,7-dione IUPAC Name: 3,8-bis(3,4-dimethylphenyl)-1,10-dimethyl-11-(2-nitrophenyl)-2,3,8,9-tetrazadispiro[4.0.4^{6}.1^{5}]undeca-1,9-diene-4,7-dione Traditional Name: 3,8-bis(3,4-dimethylphenyl)-1,10-dimethyl-11-(2-nitrophenyl)-2,3,8,9-tetrazadispiro[4.0.4^{6}.1^{5}]undeca-1,9-diene-4,7-quinone Formula: C31H29N5O4 MolecularWeight: 535.59306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3(C(C34C(=NN(C4=O)C5=CC(=C(C=C5)C)C)C)C6=CC=CC=C6[N+](=O)[O-])C(=N2)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3(C(C34C(=NN(C4=O)C5=CC(=C(C=C5)C)C)C)C6=CC=CC=C6[N+](=O)[O-])C(=N2)C)C

InChI

InChI=1S/C31H29N5O4/c1-17-11-13-23(15-19(17)3)34-28(37)30(21(5)32-34)27(25-9-7-8-10-26(25)36(39)40)31(30)22(6)33-35(29(31)38)24-14-12-18(2)20(4)16-24/h7-16,27H,1-6H3