bis[3-(6-propyl-2,3,4,9-tetrahydro-1H-carbazol-2-yl)pentan-3-yl] propanedioate

Systemtic Name: bis[3-(6-propyl-2,3,4,9-tetrahydro-1H-carbazol-2-yl)pentan-3-yl] propanedioate Openeye Name: bis[1-ethyl-1-(6-propyl-2,3,4,9-tetrahydro-1H-carbazol-2-yl)propyl] propanedioate CAS Name: propanedioic acid bis[3-(6-propyl-2,3,4,9-tetrahydro-1H-carbazol-2-yl)pentan-3-yl] ester IUPAC Name: bis[3-(6-propyl-2,3,4,9-tetrahydro-1H-carbazol-2-yl)pentan-3-yl] propanedioate Traditional Name: malonic acid bis[1-ethyl-1-(6-propyl-2,3,4,9-tetrahydro-1H-carbazol-2-yl)propyl] ester Formula: C43H58N2O4 MolecularWeight: 666.93162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)NC3=C2CCC(C3)C(CC)(CC)OC(=O)CC(=O)OC(CC)(CC)C4CCC5=C(C4)NC6=C5C=C(C=C6)CCC

Isomeric SMILES

CCCC1=CC2=C(C=C1)NC3=C2CCC(C3)C(CC)(CC)OC(=O)CC(=O)OC(CC)(CC)C4CCC5=C(C4)NC6=C5C=C(C=C6)CCC

InChI

InChI=1S/C43H58N2O4/c1-7-13-28-15-21-36-34(23-28)32-19-17-30(25-38(32)44-36)42(9-3,10-4)48-40(46)27-41(47)49-43(11-5,12-6)31-18-20-33-35-24-29(14-8-2)16-22-37(35)45-39(33)26-31/h15-16,21-24,30-31,44-45H,7-14,17-20,25-27H2,1-6H3