8-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)biphenylene-1-carbaldehyde

Systemtic Name: 8-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)biphenylene-1-carbaldehyde Openeye Name: 8-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)biphenylene-1-carbaldehyde CAS Name: 8-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)-1-biphenylenecarboxaldehyde IUPAC Name: 8-(10,15,20-triphenyl-23,24-dihydroporphyrin-5-yl)biphenylene-1-carbaldehyde Traditional Name: 8-(10,15,20-triphenyl-23,24-dihydroporphin-5-yl)biphenylene-1-carbaldehyde Formula: C51H32N4O MolecularWeight: 716.82598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC8=C9C=CC=C(C9=C87)C=O)C1=CC=CC=C1)C1=CC=CC=C1)N3

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=CC8=C9C=CC=C(C9=C87)C=O)C1=CC=CC=C1)C1=CC=CC=C1)N3

InChI

InChI=1S/C51H32N4O/c56-30-34-18-10-19-35-36-20-11-21-37(50(36)46(34)35)51-44-28-26-42(54-44)48(32-14-6-2-7-15-32)40-24-22-38(52-40)47(31-12-4-1-5-13-31)39-23-25-41(53-39)49(33-16-8-3-9-17-33)43-27-29-45(51)55-43/h1-30,52-53H