N-[4-[(Z)-2-(1,3-benzoxazol-2-yl)-2-isocyano-ethenyl]phenyl]-N-naphthalen-2-yl-phenanthren-9-amine

Systemtic Name: N-[4-[(Z)-2-(1,3-benzoxazol-2-yl)-2-isocyano-ethenyl]phenyl]-N-naphthalen-2-yl-phenanthren-9-amine Openeye Name: N-[4-[(Z)-2-(1,3-benzoxazol-2-yl)-2-isocyano-vinyl]phenyl]-N-(2-naphthyl)phenanthren-9-amine CAS Name: N-[4-[(Z)-2-(1,3-benzoxazol-2-yl)-2-isocyanoethenyl]phenyl]-N-(2-naphthalenyl)-9-phenanthrenamine IUPAC Name: N-[4-[(Z)-2-(1,3-benzoxazol-2-yl)-2-isocyanoethenyl]phenyl]-N-naphthalen-2-ylphenanthren-9-amine Traditional Name: [4-[(Z)-2-(1,3-benzoxazol-2-yl)-2-isocyano-vinyl]phenyl]-(2-naphthyl)-(9-phenanthryl)amine Formula: C40H25N3O MolecularWeight: 563.646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C(=CC1=CC=C(C=C1)N(C2=CC3=CC=CC=C3C=C2)C4=CC5=CC=CC=C5C6=CC=CC=C64)C7=NC8=CC=CC=C8O7

Isomeric SMILES

[C-]#[N+]/C(=C\C1=CC=C(C=C1)N(C2=CC3=CC=CC=C3C=C2)C4=CC5=CC=CC=C5C6=CC=CC=C64)/C7=NC8=CC=CC=C8O7

InChI

InChI=1S/C40H25N3O/c1-41-37(40-42-36-16-8-9-17-39(36)44-40)24-27-18-21-31(22-19-27)43(32-23-20-28-10-2-3-11-29(28)25-32)38-26-30-12-4-5-13-33(30)34-14-6-7-15-35(34)38/h2-26H/b37-24-