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8-bromanyl-2,3,12,13,17,18-hexaethyl-21,22-dihydroporphyrin

8-bromanyl-2,3,12,13,17,18-hexaethyl-21,22-dihydroporphyrin

Systemtic Name:8-bromanyl-2,3,12,13,17,18-hexaethyl-21,22-dihydroporphyrin
Openeye Name:8-bromo-2,3,12,13,17,18-hexaethyl-21,22-dihydroporphyrin
CAS Name:8-bromo-2,3,12,13,17,18-hexaethyl-21,22-dihydroporphyrin
IUPAC Name:8-bromo-2,3,12,13,17,18-hexaethyl-21,22-dihydroporphyrin
Traditional Name:8-bromo-2,3,12,13,17,18-hexaethyl-21,22-dihydroporphine
Formula: C32H37BrN4
MolecularWeight: 557.56698
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC1=CC3=C(C(=C(N3)C=C4C=C(C(=CC5=NC(=C2)C(=C5CC)CC)N4)Br)CC)CC)CC


Isomeric SMILES

CCC1=C(C2=NC1=CC3=C(C(=C(N3)C=C4C=C(C(=CC5=NC(=C2)C(=C5CC)CC)N4)Br)CC)CC)CC


InChI

InChI=1S/C32H37BrN4/c1-7-19-20(8-2)27-15-28-21(9-3)22(10-4)29(36-28)16-30-23(11-5)24(12-6)31(37-30)17-32-25(33)13-18(34-32)14-26(19)35-27/h13-17,34-35H,7-12H2,1-6H3


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