2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin

Systemtic Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin Openeye Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin CAS Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin IUPAC Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-21,22-dihydroporphyrin Traditional Name: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethyl-21,22-dihydroporphine Formula: C40H54N4 MolecularWeight: 590.88356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)CCCC)C)C)CCCC)CCCC)C)C

Isomeric SMILES

CCCCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=N5)C=C1N2)CCCC)C)C)CCCC)CCCC)C)C

InChI

InChI=1S/C40H54N4/c1-9-13-17-29-25(5)33-21-34-27(7)31(19-15-11-3)39(43-34)24-40-32(20-16-12-4)28(8)36(44-40)22-35-26(6)30(18-14-10-2)38(42-35)23-37(29)41-33/h21-24,41,43H,9-20H2,1-8H3