2-methylpropyl 4-[4-oxidanyl-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]butanoate

Systemtic Name: 2-methylpropyl 4-[4-oxidanyl-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]butanoate Openeye Name: isobutyl 4-[4-hydroxy-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]butanoate CAS Name: 4-[4-hydroxy-3,5-bis(1-pyrrolidinylmethyl)phenyl]butanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[4-hydroxy-3,5-bis(pyrrolidin-1-ylmethyl)phenyl]butanoate Traditional Name: 4-[4-hydroxy-3,5-bis(pyrrolidinomethyl)phenyl]butyric acid isobutyl ester Formula: C24H38N2O3 MolecularWeight: 402.57012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CCCC1=CC(=C(C(=C1)CN2CCCC2)O)CN3CCCC3

Isomeric SMILES

CC(C)COC(=O)CCCC1=CC(=C(C(=C1)CN2CCCC2)O)CN3CCCC3

InChI

InChI=1S/C24H38N2O3/c1-19(2)18-29-23(27)9-7-8-20-14-21(16-25-10-3-4-11-25)24(28)22(15-20)17-26-12-5-6-13-26/h14-15,19,28H,3-13,16-18H2,1-2H3