5-(4-methoxyphenyl)-10,15,20-tripentyl-21,22-dihydroporphyrin

Systemtic Name: 5-(4-methoxyphenyl)-10,15,20-tripentyl-21,22-dihydroporphyrin Openeye Name: 5-(4-methoxyphenyl)-10,15,20-tripentyl-21,22-dihydroporphyrin CAS Name: 5-(4-methoxyphenyl)-10,15,20-tripentyl-21,22-dihydroporphyrin IUPAC Name: 5-(4-methoxyphenyl)-10,15,20-tripentyl-21,22-dihydroporphyrin Traditional Name: 10,15,20-triamyl-5-(4-methoxyphenyl)-21,22-dihydroporphine Formula: C42H50N4O MolecularWeight: 626.8726

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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=C(C=C6)OC)N2

Isomeric SMILES

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

InChI

InChI=1S/C42H50N4O/c1-5-8-11-14-31-34-21-23-36(43-34)32(15-12-9-6-2)38-25-27-40(45-38)42(29-17-19-30(47-4)20-18-29)41-28-26-39(46-41)33(16-13-10-7-3)37-24-22-35(31)44-37/h17-28,45-46H,5-16H2,1-4H3