10-butyl-15-hexyl-5-(4-methoxyphenyl)-20-pentyl-21,22-dihydroporphyrin

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC1=N5)CCCCC)C6=CC=C(C=C6)OC)N3)CCCC

Isomeric SMILES

CCCCCCC1=C2C=CC(=N2)C(=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC1=N5)CCCCC)C6=CC=C(C=C6)OC)N3)CCCC

InChI

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