diethyl 10,20-diethyl-21,24-dihydroporphyrin-5,15-dicarboxylate

Systemtic Name: diethyl 10,20-diethyl-21,24-dihydroporphyrin-5,15-dicarboxylate Openeye Name: diethyl 10,20-diethyl-21,24-dihydroporphyrin-5,15-dicarboxylate CAS Name: 10,20-diethyl-21,24-dihydroporphyrin-5,15-dicarboxylic acid diethyl ester IUPAC Name: diethyl 10,20-diethyl-21,24-dihydroporphyrin-5,15-dicarboxylate Traditional Name: 10,20-diethyl-21,24-dihydroporphine-5,15-dicarboxylic acid diethyl ester Formula: C30H30N4O4 MolecularWeight: 510.5836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C=CC(=C(C3=NC(=C(C4=NC(=C(C5=CC=C1N5)C(=O)OCC)C=C4)CC)C=C3)C(=O)OCC)N2

Isomeric SMILES

CCC1=C2C=CC(=C(C3=NC(=C(C4=NC(=C(C5=CC=C1N5)C(=O)OCC)C=C4)CC)C=C3)C(=O)OCC)N2

InChI

InChI=1S/C30H30N4O4/c1-5-17-19-9-13-23(31-19)27(29(35)37-7-3)25-15-11-21(33-25)18(6-2)22-12-16-26(34-22)28(30(36)38-8-4)24-14-10-20(17)32-24/h9-16,31-32H,5-8H2,1-4H3