10,15,20-tripentyl-5-phenyl-21,22-dihydroporphyrin

Systemtic Name: 10,15,20-tripentyl-5-phenyl-21,22-dihydroporphyrin Openeye Name: 10,15,20-tripentyl-5-phenyl-21,22-dihydroporphyrin CAS Name: 10,15,20-tripentyl-5-phenyl-21,22-dihydroporphyrin IUPAC Name: 10,15,20-tripentyl-5-phenyl-21,22-dihydroporphyrin Traditional Name: 10,15,20-triamyl-5-phenyl-21,22-dihydroporphine Formula: C41H48N4 MolecularWeight: 596.84662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C2C=CC(=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)CCCCC)CCCCC)C6=CC=CC=C6)N2

Isomeric SMILES

CCCCCC1=C2C=CC(=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)CCCCC)CCCCC)C6=CC=CC=C6)N2

InChI

InChI=1S/C41H48N4/c1-4-7-11-18-30-33-21-23-35(42-33)31(19-12-8-5-2)37-25-27-39(44-37)41(29-16-14-10-15-17-29)40-28-26-38(45-40)32(20-13-9-6-3)36-24-22-34(30)43-36/h10,14-17,21-28,44-45H,4-9,11-13,18-20H2,1-3H3