methyl (3S,4S)-3-(cyclohexen-1-ylmethyl)-4-methyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S,4S)-3-(cyclohexen-1-ylmethyl)-4-methyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Openeye Name: methyl (3S,4S)-3-(cyclohexen-1-ylmethyl)-4-methyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate CAS Name: (3S,4S)-3-(1-cyclohexenylmethyl)-4-methyl-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4S)-3-(cyclohexen-1-ylmethyl)-4-methyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylate Traditional Name: (3S,4S)-3-(cyclohexen-1-ylmethyl)-4-methyl-1-[(1R)-1-phenylethyl]pyrrolidine-3-carboxylic acid methyl ester Formula: C22H31NO2 MolecularWeight: 341.48704

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC1(CC2=CCCCC2)C(=O)OC)C(C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CN(C[C@@]1(CC2=CCCCC2)C(=O)OC)[C@H](C)C3=CC=CC=C3

InChI

InChI=1S/C22H31NO2/c1-17-15-23(18(2)20-12-8-5-9-13-20)16-22(17,21(24)25-3)14-19-10-6-4-7-11-19/h5,8-10,12-13,17-18H,4,6-7,11,14-16H2,1-3H3/t17-,18-,22-/m1/s1