3-[18-(2-carboxyethyl)-8-ethenyl-13-(1-methoxyethyl)-3,7,12,17-tetramethyl-2,3,22,23-tetrahydroporphyrin-2-yl]propanoic acid

Systemtic Name: 3-[18-(2-carboxyethyl)-8-ethenyl-13-(1-methoxyethyl)-3,7,12,17-tetramethyl-2,3,22,23-tetrahydroporphyrin-2-yl]propanoic acid Openeye Name: 3-[18-(2-carboxyethyl)-13-(1-methoxyethyl)-3,7,12,17-tetramethyl-8-vinyl-2,3,22,23-tetrahydroporphyrin-2-yl]propanoic acid CAS Name: 3-[18-(2-carboxyethyl)-8-ethenyl-13-(1-methoxyethyl)-3,7,12,17-tetramethyl-2,3,22,23-tetrahydroporphyrin-2-yl]propanoic acid IUPAC Name: 3-[18-(2-carboxyethyl)-8-ethenyl-13-(1-methoxyethyl)-3,7,12,17-tetramethyl-2,3,22,23-tetrahydroporphyrin-2-yl]propanoic acid Traditional Name: 3-[18-(2-carboxyethyl)-13-(1-methoxyethyl)-3,7,12,17-tetramethyl-8-vinyl-2,3,22,23-tetrahydroporphin-2-yl]propionic acid Formula: C35H40N4O5 MolecularWeight: 596.7159

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=CC3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=CC1=N2)N5)C)C=C)C)C(C)OC)C(=C3CCC(=O)O)C)CCC(=O)O

Isomeric SMILES

CC1C(C2=CC3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=CC1=N2)N5)C)C=C)C)C(C)OC)C(=C3CCC(=O)O)C)CCC(=O)O

InChI

InChI=1S/C35H40N4O5/c1-8-22-17(2)25-13-26-18(3)23(9-11-33(40)41)30(37-26)16-31-24(10-12-34(42)43)19(4)27(38-31)15-32-35(21(6)44-7)20(5)28(39-32)14-29(22)36-25/h8,13-16,18,21,23,36,39H,1,9-12H2,2-7H3,(H,40,41)(H,42,43)