methyl 4-(4-propylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)benzoate

Systemtic Name: methyl 4-(4-propylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)benzoate Openeye Name: methyl 4-(4-propylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)benzoate CAS Name: 4-(4-propyl-1-piperazinyl)-3-(3,3,5,5-tetramethylcyclohexyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-propylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)benzoate Traditional Name: 4-(4-propylpiperazino)-3-(3,3,5,5-tetramethylcyclohexyl)benzoic acid methyl ester Formula: C25H40N2O2 MolecularWeight: 400.5973

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)C3CC(CC(C3)(C)C)(C)C

Isomeric SMILES

CCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)C3CC(CC(C3)(C)C)(C)C

InChI

InChI=1S/C25H40N2O2/c1-7-10-26-11-13-27(14-12-26)22-9-8-19(23(28)29-6)15-21(22)20-16-24(2,3)18-25(4,5)17-20/h8-9,15,20H,7,10-14,16-18H2,1-6H3