10,15,20-tris(methoxycarbonyl)-21,22-dihydroporphyrin-5-carboxylic acid

Systemtic Name: 10,15,20-tris(methoxycarbonyl)-21,22-dihydroporphyrin-5-carboxylic acid Openeye Name: 10,15,20-tris(methoxycarbonyl)-21,22-dihydroporphyrin-5-carboxylic acid CAS Name: 10,15,20-tris(methoxycarbonyl)-21,22-dihydroporphyrin-5-carboxylic acid IUPAC Name: 10,15,20-tris(methoxycarbonyl)-21,22-dihydroporphyrin-5-carboxylic acid Traditional Name: 10,15,20-tricarbomethoxy-21,22-dihydroporphine-5-carboxylic acid Formula: C27H20N4O8 MolecularWeight: 528.4697

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C=CC(=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C(=O)OC)C(=O)OC)C(=O)O)N2

Isomeric SMILES

COC(=O)C1=C2C=CC(=C(C3=CC=C(N3)C(=C4C=CC(=N4)C(=C5C=CC1=N5)C(=O)OC)C(=O)OC)C(=O)O)N2

InChI

InChI=1S/C27H20N4O8/c1-37-25(34)21-14-6-4-12(28-14)20(24(32)33)13-5-7-15(29-13)22(26(35)38-2)17-9-11-19(31-17)23(27(36)39-3)18-10-8-16(21)30-18/h4-11,28-29H,1-3H3,(H,32,33)