3-pyrrolidin-1-ylbutyl 2,6-dimethyl-4-propoxy-benzoate

Systemtic Name: 3-pyrrolidin-1-ylbutyl 2,6-dimethyl-4-propoxy-benzoate Openeye Name: 3-pyrrolidin-1-ylbutyl 2,6-dimethyl-4-propoxy-benzoate CAS Name: 2,6-dimethyl-4-propoxybenzoic acid 3-(1-pyrrolidinyl)butyl ester IUPAC Name: 3-pyrrolidin-1-ylbutyl 2,6-dimethyl-4-propoxybenzoate Traditional Name: 2,6-dimethyl-4-propoxy-benzoic acid 3-pyrrolidinobutyl ester Formula: C20H31NO3 MolecularWeight: 333.46504

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C(=C1)C)C(=O)OCCC(C)N2CCCC2)C

Isomeric SMILES

CCCOC1=CC(=C(C(=C1)C)C(=O)OCCC(C)N2CCCC2)C

InChI

InChI=1S/C20H31NO3/c1-5-11-23-18-13-15(2)19(16(3)14-18)20(22)24-12-8-17(4)21-9-6-7-10-21/h13-14,17H,5-12H2,1-4H3