5,10,20-triphenyl-15-[(E)-2-phenylethenyl]-21,22-dihydroporphyrin

Systemtic Name: 5,10,20-triphenyl-15-[(E)-2-phenylethenyl]-21,22-dihydroporphyrin Openeye Name: 5,10,20-triphenyl-15-[(E)-styryl]-21,22-dihydroporphyrin CAS Name: 5,10,20-triphenyl-15-[(E)-2-phenylethenyl]-21,22-dihydroporphyrin IUPAC Name: 5,10,20-triphenyl-15-[(E)-2-phenylethenyl]-21,22-dihydroporphyrin Traditional Name: 5,10,20-triphenyl-15-[(E)-styryl]-21,22-dihydroporphine Formula: C46H32N4 MolecularWeight: 640.77308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9

InChI

InChI=1S/C46H32N4/c1-5-13-31(14-6-1)21-22-35-36-23-25-38(47-36)44(32-15-7-2-8-16-32)40-27-29-42(49-40)46(34-19-11-4-12-20-34)43-30-28-41(50-43)45(33-17-9-3-10-18-33)39-26-24-37(35)48-39/h1-30,49-50H/b22-21+,36-35?,37-35?,44-38?,44-40?,45-39?,45-41?,46-42?,46-43?