methyl 3-[7-(2-chloroethyl)-13,17-diethyl-3,8,12,18-tetramethyl-23,24-dihydroporphyrin-2-yl]propanoate

Systemtic Name: methyl 3-[7-(2-chloroethyl)-13,17-diethyl-3,8,12,18-tetramethyl-23,24-dihydroporphyrin-2-yl]propanoate Openeye Name: methyl 3-[7-(2-chloroethyl)-13,17-diethyl-3,8,12,18-tetramethyl-23,24-dihydroporphyrin-2-yl]propanoate CAS Name: 3-[7-(2-chloroethyl)-13,17-diethyl-3,8,12,18-tetramethyl-23,24-dihydroporphyrin-2-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[7-(2-chloroethyl)-13,17-diethyl-3,8,12,18-tetramethyl-23,24-dihydroporphyrin-2-yl]propanoate Traditional Name: 3-[7-(2-chloroethyl)-13,17-diethyl-3,8,12,18-tetramethyl-23,24-dihydroporphin-2-yl]propionic acid methyl ester Formula: C34H39ClN4O2 MolecularWeight: 571.15206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)C)C(=C4C)CCC(=O)OC)C(=C3C)CCCl)C

Isomeric SMILES

CCC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)CC)C)C(=C4C)CCC(=O)OC)C(=C3C)CCCl)C

InChI

InChI=1S/C34H39ClN4O2/c1-8-22-18(3)26-14-27-21(6)25(12-13-35)33(38-27)16-29-20(5)24(10-11-34(40)41-7)32(39-29)15-28-19(4)23(9-2)31(37-28)17-30(22)36-26/h14-17,36-37H,8-13H2,1-7H3