2-methylpropyl 4-oxidanyl-3,5-bis(pyrrolidin-1-ylmethyl)benzoate

Systemtic Name: 2-methylpropyl 4-oxidanyl-3,5-bis(pyrrolidin-1-ylmethyl)benzoate Openeye Name: isobutyl 4-hydroxy-3,5-bis(pyrrolidin-1-ylmethyl)benzoate CAS Name: 4-hydroxy-3,5-bis(1-pyrrolidinylmethyl)benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-hydroxy-3,5-bis(pyrrolidin-1-ylmethyl)benzoate Traditional Name: 4-hydroxy-3,5-bis(pyrrolidinomethyl)benzoic acid isobutyl ester Formula: C21H32N2O3 MolecularWeight: 360.49038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC(=C(C(=C1)CN2CCCC2)O)CN3CCCC3

Isomeric SMILES

CC(C)COC(=O)C1=CC(=C(C(=C1)CN2CCCC2)O)CN3CCCC3

InChI

InChI=1S/C21H32N2O3/c1-16(2)15-26-21(25)17-11-18(13-22-7-3-4-8-22)20(24)19(12-17)14-23-9-5-6-10-23/h11-12,16,24H,3-10,13-15H2,1-2H3