4-[bis(5-methyl-2-propan-2-yl-cyclohexyl)amino]-2-ethyl-benzoate

Systemtic Name: 4-[bis(5-methyl-2-propan-2-yl-cyclohexyl)amino]-2-ethyl-benzoate Openeye Name: 4-[bis(2-isopropyl-5-methyl-cyclohexyl)amino]-2-ethyl-benzoate CAS Name: 4-[bis(5-methyl-2-propan-2-ylcyclohexyl)amino]-2-ethylbenzoate IUPAC Name: 4-[bis(5-methyl-2-propan-2-ylcyclohexyl)amino]-2-ethylbenzoate Traditional Name: 4-[bis(2-isopropyl-5-methyl-cyclohexyl)amino]-2-ethyl-benzoate Formula: C29H46NO2- MolecularWeight: 440.68104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)N(C2CC(CCC2C(C)C)C)C3CC(CCC3C(C)C)C)C(=O)[O-]

Isomeric SMILES

CCC1=C(C=CC(=C1)N(C2CC(CCC2C(C)C)C)C3CC(CCC3C(C)C)C)C(=O)[O-]

InChI

InChI=1S/C29H47NO2/c1-8-22-17-23(11-14-26(22)29(31)32)30(27-15-20(6)9-12-24(27)18(2)3)28-16-21(7)10-13-25(28)19(4)5/h11,14,17-21,24-25,27-28H,8-10,12-13,15-16H2,1-7H3,(H,31,32)/p-1