(19Z)-5,10,15,20-tetratert-butyl-15-methoxy-21,22-dihydro-5H-porphyrin

Systemtic Name: (19Z)-5,10,15,20-tetratert-butyl-15-methoxy-21,22-dihydro-5H-porphyrin Openeye Name: (19Z)-5,10,15,20-tetratert-butyl-15-methoxy-21,22-dihydro-5H-porphyrin CAS Name: (19Z)-5,10,15,20-tetratert-butyl-15-methoxy-21,22-dihydro-5H-porphyrin IUPAC Name: (19Z)-5,10,15,20-tetratert-butyl-15-methoxy-21,22-dihydro-5H-porphyrin Traditional Name: (19Z)-5,10,15,20-tetratert-butyl-15-methoxy-21,22-dihydro-5H-porphine Formula: C37H50N4O MolecularWeight: 566.8191

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C2=CC=C(N2)C(=C3C=CC(=N3)C(C4=NC(=C(C5=CC=C1N5)C(C)(C)C)C=C4)(C(C)(C)C)OC)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1C2=CC=C(N2)C(=C3C=CC(=N3)C(C4=N/C(=C(\C5=CC=C1N5)/C(C)(C)C)/C=C4)(C(C)(C)C)OC)C(C)(C)C

InChI

InChI=1S/C37H50N4O/c1-33(2,3)30-22-14-16-24(38-22)31(34(4,5)6)26-18-20-28(40-26)37(42-13,36(10,11)12)29-21-19-27(41-29)32(35(7,8)9)25-17-15-23(30)39-25/h14-21,30,38-39H,1-13H3/b31-26+,32-27?