methyl 3-(12,18-diethyl-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoate

Systemtic Name: methyl 3-(12,18-diethyl-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoate Openeye Name: methyl 3-(12,18-diethyl-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoate CAS Name: 3-(12,18-diethyl-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(12,18-diethyl-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl)propanoate Traditional Name: 3-(12,18-diethyl-3,8,13,17-tetramethyl-22,23-dihydroporphin-2-yl)propionic acid methyl ester Formula: C32H36N4O2 MolecularWeight: 508.65384

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=CC(=CC5=NC(=CC1=N2)C(=C5C)CCC(=O)OC)N4)C)CC)C)C

Isomeric SMILES

CCC1=C(C2=CC3=C(C(=C(N3)C=C4C(=CC(=CC5=NC(=CC1=N2)C(=C5C)CCC(=O)OC)N4)C)CC)C)C

InChI

InChI=1S/C32H36N4O2/c1-8-22-18(4)27-15-28-19(5)23(9-2)30(36-28)16-31-24(10-11-32(37)38-7)20(6)26(34-31)13-21-12-17(3)25(33-21)14-29(22)35-27/h12-16,33,35H,8-11H2,1-7H3