10,20-diheptyl-15-(1-methylimidazol-2-yl)-21,22-dihydroporphyrin

Systemtic Name: 10,20-diheptyl-15-(1-methylimidazol-2-yl)-21,22-dihydroporphyrin Openeye Name: 10,20-diheptyl-15-(1-methylimidazol-2-yl)-21,22-dihydroporphyrin CAS Name: 10,20-diheptyl-15-(1-methyl-2-imidazolyl)-21,22-dihydroporphyrin IUPAC Name: 10,20-diheptyl-15-(1-methylimidazol-2-yl)-21,22-dihydroporphyrin Traditional Name: 10,20-diheptyl-15-(1-methylimidazol-2-yl)-21,22-dihydroporphine Formula: C38H46N6 MolecularWeight: 586.81204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C2C=CC(=CC3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C6=NC=CN6C)CCCCCCC)N2

Isomeric SMILES

CCCCCCCC1=C2C=CC(=CC3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C6=NC=CN6C)CCCCCCC)N2

InChI

InChI=1S/C38H46N6/c1-4-6-8-10-12-14-29-31-18-16-27(40-31)26-28-17-19-32(41-28)30(15-13-11-9-7-5-2)34-21-23-36(43-34)37(35-22-20-33(29)42-35)38-39-24-25-44(38)3/h16-26,40-41H,4-15H2,1-3H3