18-(2-carboxyethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-21,23-dihydroporphyrin-2-carboxylic acid

Systemtic Name: 18-(2-carboxyethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-21,23-dihydroporphyrin-2-carboxylic acid Openeye Name: 18-(2-carboxyethyl)-7-ethyl-3,8,13,17-tetramethyl-12-vinyl-21,23-dihydroporphyrin-2-carboxylic acid CAS Name: 18-(2-carboxyethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-21,23-dihydroporphyrin-2-carboxylic acid IUPAC Name: 18-(2-carboxyethyl)-12-ethenyl-7-ethyl-3,8,13,17-tetramethyl-21,23-dihydroporphyrin-2-carboxylic acid Traditional Name: 18-(2-carboxyethyl)-7-ethyl-3,8,13,17-tetramethyl-12-vinyl-21,23-dihydroporphine-2-carboxylic acid Formula: C32H32N4O4 MolecularWeight: 536.62088

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC1=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=C2)N5)C=C)C)C)CCC(=O)O)C(=O)O)C)C

Isomeric SMILES

CCC1=C(C2=NC1=CC3=C(C(=C(N3)C=C4C(=C(C(=N4)C=C5C(=C(C(=C2)N5)C=C)C)C)CCC(=O)O)C(=O)O)C)C

InChI

InChI=1S/C32H32N4O4/c1-7-19-15(3)22-11-23-17(5)21(9-10-30(37)38)28(35-23)14-29-31(32(39)40)18(6)25(36-29)13-27-20(8-2)16(4)24(34-27)12-26(19)33-22/h7,11-14,33,36H,1,8-10H2,2-6H3,(H,37,38)(H,39,40)