methyl 4-[1-(phenylmethyl)-2-propan-2-yl-pyrrolidin-2-yl]benzoate

Systemtic Name: methyl 4-[1-(phenylmethyl)-2-propan-2-yl-pyrrolidin-2-yl]benzoate Openeye Name: methyl 4-(1-benzyl-2-isopropyl-pyrrolidin-2-yl)benzoate CAS Name: 4-[1-(phenylmethyl)-2-propan-2-yl-2-pyrrolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-(1-benzyl-2-propan-2-ylpyrrolidin-2-yl)benzoate Traditional Name: 4-(1-benzyl-2-isopropyl-pyrrolidin-2-yl)benzoic acid methyl ester Formula: C22H27NO2 MolecularWeight: 337.45528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CCCN1CC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)C1(CCCN1CC2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H27NO2/c1-17(2)22(20-12-10-19(11-13-20)21(24)25-3)14-7-15-23(22)16-18-8-5-4-6-9-18/h4-6,8-13,17H,7,14-16H2,1-3H3