methyl 2-[5-aminocarbonyl-2-(5-cyanopentyl)-9-tetradecyl-carbazol-3-yl]oxyethanoate

Systemtic Name: methyl 2-[5-aminocarbonyl-2-(5-cyanopentyl)-9-tetradecyl-carbazol-3-yl]oxyethanoate Openeye Name: methyl 2-[5-carbamoyl-2-(5-cyanopentyl)-9-tetradecyl-carbazol-3-yl]oxyacetate CAS Name: 2-[[5-carbamoyl-2-(5-cyanopentyl)-9-tetradecyl-3-carbazolyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[5-carbamoyl-2-(5-cyanopentyl)-9-tetradecylcarbazol-3-yl]oxyacetate Traditional Name: 2-[5-carbamoyl-2-(5-cyanopentyl)-9-myristyl-carbazol-3-yl]oxyacetic acid methyl ester Formula: C36H51N3O4 MolecularWeight: 589.80784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCN1C2=CC=CC(=C2C3=CC(=C(C=C31)CCCCCC#N)OCC(=O)OC)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCN1C2=CC=CC(=C2C3=CC(=C(C=C31)CCCCCC#N)OCC(=O)OC)C(=O)N

InChI

InChI=1S/C36H51N3O4/c1-3-4-5-6-7-8-9-10-11-12-15-18-24-39-31-22-19-21-29(36(38)41)35(31)30-26-33(43-27-34(40)42-2)28(25-32(30)39)20-16-13-14-17-23-37/h19,21-22,25-26H,3-18,20,24,27H2,1-2H3,(H2,38,41)