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5,15-dibutyl-21,22-dihydroporphyrin

5,15-dibutyl-21,22-dihydroporphyrin

Systemtic Name:5,15-dibutyl-21,22-dihydroporphyrin
Openeye Name:5,15-dibutyl-21,22-dihydroporphyrin
CAS Name:5,15-dibutyl-21,22-dihydroporphyrin
IUPAC Name:5,15-dibutyl-21,22-dihydroporphyrin
Traditional Name:5,15-dibutyl-21,22-dihydroporphine
Formula: C28H30N4
MolecularWeight: 422.5646
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C=CC(=CC3=NC(=C(C4=NC(=CC5=CC=C1N5)C=C4)CCCC)C=C3)N2


Isomeric SMILES

CCCCC1=C2C=CC(=CC3=NC(=C(C4=NC(=CC5=CC=C1N5)C=C4)CCCC)C=C3)N2


InChI

InChI=1S/C28H30N4/c1-3-5-7-23-25-13-9-19(29-25)17-21-11-15-27(31-21)24(8-6-4-2)28-16-12-22(32-28)18-20-10-14-26(23)30-20/h9-18,29-30H,3-8H2,1-2H3


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