15-butyl-5,10,20-triphenyl-21,22-dihydroporphyrin

Systemtic Name: 15-butyl-5,10,20-triphenyl-21,22-dihydroporphyrin Openeye Name: 15-butyl-5,10,20-triphenyl-21,22-dihydroporphyrin CAS Name: 15-butyl-5,10,20-triphenyl-21,22-dihydroporphyrin IUPAC Name: 15-butyl-5,10,20-triphenyl-21,22-dihydroporphyrin Traditional Name: 15-butyl-5,10,20-triphenyl-21,22-dihydroporphine Formula: C42H34N4 MolecularWeight: 594.74616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC1=N5)C6=CC=CC=C6)C7=CC=CC=C7)N3)C8=CC=CC=C8

Isomeric SMILES

CCCCC1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC1=N5)C6=CC=CC=C6)C7=CC=CC=C7)N3)C8=CC=CC=C8

InChI

InChI=1S/C42H34N4/c1-2-3-19-31-32-20-22-34(43-32)40(28-13-7-4-8-14-28)36-24-26-38(45-36)42(30-17-11-6-12-18-30)39-27-25-37(46-39)41(29-15-9-5-10-16-29)35-23-21-33(31)44-35/h4-18,20-27,45-46H,2-3,19H2,1H3