O4-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) O1-(2-methylpropyl) 2-phenylbutanedioate

Systemtic Name: O4-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) O1-(2-methylpropyl) 2-phenylbutanedioate Openeye Name: O1-isobutyl O4-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-phenylbutanedioate CAS Name: 2-phenylbutanedioic acid O4-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester O1-(2-methylpropyl) ester IUPAC Name: 4-O-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1-O-(2-methylpropyl) 2-phenylbutanedioate Traditional Name: 2-phenylsuccinic acid O1-isobutyl ester O4-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester Formula: C22H31NO4 MolecularWeight: 373.48584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(CC(=O)OC1CC2CCC(C1)N2C)C3=CC=CC=C3

Isomeric SMILES

CC(C)COC(=O)C(CC(=O)OC1CC2CCC(C1)N2C)C3=CC=CC=C3

InChI

InChI=1S/C22H31NO4/c1-15(2)14-26-22(25)20(16-7-5-4-6-8-16)13-21(24)27-19-11-17-9-10-18(12-19)23(17)3/h4-8,15,17-20H,9-14H2,1-3H3