3-methylbutyl 6-methyl-5-(phenylcarbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: 3-methylbutyl 6-methyl-5-(phenylcarbonyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: isopentyl 5-benzoyl-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-benzoyl-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 5-benzoyl-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-benzoyl-6-methyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid isoamyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2CCC(C2=C1)C(=O)OCCC(C)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(N2CCC(C2=C1)C(=O)OCCC(C)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25NO3/c1-14(2)10-12-25-21(24)17-9-11-22-18(17)13-15(3)19(22)20(23)16-7-5-4-6-8-16/h4-8,13-14,17H,9-12H2,1-3H3