6,11-bis(3,6-dimethylcarbazol-9-yl)-3-phenyl-phenanthro[9,10-b]pyrazine

Systemtic Name: 6,11-bis(3,6-dimethylcarbazol-9-yl)-3-phenyl-phenanthro[9,10-b]pyrazine Openeye Name: 6,11-bis(3,6-dimethylcarbazol-9-yl)-3-phenyl-phenanthro[9,10-b]pyrazine CAS Name: 6,11-bis(3,6-dimethyl-9-carbazolyl)-3-phenylphenanthro[9,10-b]pyrazine IUPAC Name: 6,11-bis(3,6-dimethylcarbazol-9-yl)-3-phenylphenanthro[9,10-b]pyrazine Traditional Name: 6,11-bis(3,6-dimethylcarbazol-9-yl)-3-phenyl-phenanthro[9,10-b]pyrazine Formula: C50H36N4 MolecularWeight: 692.84764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C3=C2C=C(C=C3)C)C4=CC5=C(C=C4)C6=C(C=C(C=C6)N7C8=C(C=C(C=C8)C)C9=C7C=CC(=C9)C)C1=NC(=CN=C51)C1=CC=CC=C1

Isomeric SMILES

CC1=CC2=C(C=C1)N(C3=C2C=C(C=C3)C)C4=CC5=C(C=C4)C6=C(C=C(C=C6)N7C8=C(C=C(C=C8)C)C9=C7C=CC(=C9)C)C1=NC(=CN=C51)C1=CC=CC=C1

InChI

InChI=1S/C50H36N4/c1-29-10-18-45-38(22-29)39-23-30(2)11-19-46(39)53(45)34-14-16-36-37-17-15-35(54-47-20-12-31(3)24-40(47)41-25-32(4)13-21-48(41)54)27-43(37)50-49(42(36)26-34)51-28-44(52-50)33-8-6-5-7-9-33/h5-28H,1-4H3