4-[[7-[(4-isocyanophenyl)-phenyl-amino]-9,10-dihydrophenanthren-2-yl]-phenyl-amino]benzenecarbonitrile

Systemtic Name: 4-[[7-[(4-isocyanophenyl)-phenyl-amino]-9,10-dihydrophenanthren-2-yl]-phenyl-amino]benzenecarbonitrile Openeye Name: 4-(N-[7-(N-(4-isocyanophenyl)anilino)-9,10-dihydrophenanthren-2-yl]anilino)benzonitrile CAS Name: 4-(N-[7-(N-(4-isocyanophenyl)anilino)-9,10-dihydrophenanthren-2-yl]anilino)benzonitrile IUPAC Name: 4-(N-[7-(N-(4-isocyanophenyl)anilino)-9,10-dihydrophenanthren-2-yl]anilino)benzonitrile Traditional Name: 4-(N-[7-(N-(4-isocyanophenyl)anilino)-9,10-dihydrophenanthren-2-yl]anilino)benzonitrile Formula: C40H28N4 MolecularWeight: 564.67712

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC4=C(C=C3)C5=C(CC4)C=C(C=C5)N(C6=CC=CC=C6)C7=CC=C(C=C7)C#N

Isomeric SMILES

[C-]#[N+]C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC4=C(C=C3)C5=C(CC4)C=C(C=C5)N(C6=CC=CC=C6)C7=CC=C(C=C7)C#N

InChI

InChI=1S/C40H28N4/c1-42-32-16-20-36(21-17-32)44(34-10-6-3-7-11-34)38-23-25-40-31(27-38)15-14-30-26-37(22-24-39(30)40)43(33-8-4-2-5-9-33)35-18-12-29(28-41)13-19-35/h2-13,16-27H,14-15H2