methyl 12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-18-propyl-17,18,21,23-tetrahydroporphyrin-2-carboxylate

Systemtic Name: methyl 12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-18-propyl-17,18,21,23-tetrahydroporphyrin-2-carboxylate Openeye Name: methyl 7-ethyl-3,8,13,17-tetramethyl-18-propyl-12-vinyl-17,18,21,23-tetrahydroporphyrin-2-carboxylate CAS Name: 12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-18-propyl-17,18,21,23-tetrahydroporphyrin-2-carboxylic acid methyl ester IUPAC Name: methyl 12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-18-propyl-17,18,21,23-tetrahydroporphyrin-2-carboxylate Traditional Name: 7-ethyl-3,8,13,17-tetramethyl-18-propyl-12-vinyl-17,18,21,23-tetrahydroporphine-2-carboxylic acid methyl ester Formula: C33H38N4O2 MolecularWeight: 522.68042

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C2=NC1=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=C2)N5)C)C=C)C)CC)C)C(=O)OC)C

Isomeric SMILES

CCCC1C(C2=NC1=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=C2)N5)C)C=C)C)CC)C)C(=O)OC)C

InChI

InChI=1S/C33H38N4O2/c1-9-12-23-19(6)25-13-24-17(4)21(10-2)28(34-24)14-26-18(5)22(11-3)29(35-26)15-27-20(7)32(33(38)39-8)31(37-27)16-30(23)36-25/h10,13-16,19,23,34,37H,2,9,11-12H2,1,3-8H3