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

Systemtic Name: bis[4-(6-chloranyl-2,3,4,9-tetrahydro-1H-carbazol-2-yl)heptan-4-yl] propanedioate Openeye Name: bis[1-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)-1-propyl-butyl] propanedioate CAS Name: propanedioic acid bis[4-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)heptan-4-yl] ester IUPAC Name: bis[4-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)heptan-4-yl] propanedioate Traditional Name: malonic acid bis[1-(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-2-yl)-1-propyl-butyl] ester Formula: C41H52Cl2N2O4 MolecularWeight: 707.76858

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)(C1CCC2=C(C1)NC3=C2C=C(C=C3)Cl)OC(=O)CC(=O)OC(CCC)(CCC)C4CCC5=C(C4)NC6=C5C=C(C=C6)Cl

Isomeric SMILES

CCCC(CCC)(C1CCC2=C(C1)NC3=C2C=C(C=C3)Cl)OC(=O)CC(=O)OC(CCC)(CCC)C4CCC5=C(C4)NC6=C5C=C(C=C6)Cl

InChI

InChI=1S/C41H52Cl2N2O4/c1-5-17-40(18-6-2,26-9-13-30-32-23-28(42)11-15-34(32)44-36(30)21-26)48-38(46)25-39(47)49-41(19-7-3,20-8-4)27-10-14-31-33-24-29(43)12-16-35(33)45-37(31)22-27/h11-12,15-16,23-24,26-27,44-45H,5-10,13-14,17-22,25H2,1-4H3