methyl 3-[7,13-diethyl-18-(3-methoxy-3-oxidanylidene-propyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-12,13-bis(oxidanyl)-21,24-dihydroporphyrin-2-yl]propanoate

Systemtic Name: methyl 3-[7,13-diethyl-18-(3-methoxy-3-oxidanylidene-propyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-12,13-bis(oxidanyl)-21,24-dihydroporphyrin-2-yl]propanoate Openeye Name: methyl 3-[7,13-diethyl-12,13-dihydroxy-18-(3-methoxy-3-oxo-propyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoate CAS Name: 3-[7,13-diethyl-12,13-dihydroxy-18-(3-methoxy-3-oxopropyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[7,13-diethyl-12,13-dihydroxy-18-(3-methoxy-3-oxopropyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphyrin-2-yl]propanoate Traditional Name: 3-[7,13-diethyl-12,13-dihydroxy-18-(3-keto-3-methoxy-propyl)-10-(4-methoxyphenyl)-3,8,12,17-tetramethyl-21,24-dihydroporphin-2-yl]propionic acid methyl ester Formula: C43H50N4O7 MolecularWeight: 734.8797

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=CC1=N2)N5)C)CCC(=O)OC)CCC(=O)OC)C)C(C3(C)O)(CC)O)C6=CC=C(C=C6)OC)C

Isomeric SMILES

CCC1=C(C2=C(C3=NC(=CC4=C(C(=C(N4)C=C5C(=C(C(=CC1=N2)N5)C)CCC(=O)OC)CCC(=O)OC)C)C(C3(C)O)(CC)O)C6=CC=C(C=C6)OC)C

InChI

InChI=1S/C43H50N4O7/c1-10-28-25(5)40-39(26-12-14-27(52-7)15-13-26)41-42(6,50)43(51,11-2)36(47-41)22-32-24(4)30(17-19-38(49)54-9)35(45-32)21-34-29(16-18-37(48)53-8)23(3)31(44-34)20-33(28)46-40/h12-15,20-22,44-45,50-51H,10-11,16-19H2,1-9H3