methyl 4-(3-but-2-ynoxy-4-methoxy-phenyl)-3-(1-hydroxyethyl)-3-methyl-pyrrolidine-1-carboxylate

Systemtic Name: methyl 4-(3-but-2-ynoxy-4-methoxy-phenyl)-3-(1-hydroxyethyl)-3-methyl-pyrrolidine-1-carboxylate Openeye Name: methyl 4-(3-but-2-ynoxy-4-methoxy-phenyl)-3-(1-hydroxyethyl)-3-methyl-pyrrolidine-1-carboxylate CAS Name: 4-(3-but-2-ynoxy-4-methoxyphenyl)-3-(1-hydroxyethyl)-3-methyl-1-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-but-2-ynoxy-4-methoxyphenyl)-3-(1-hydroxyethyl)-3-methylpyrrolidine-1-carboxylate Traditional Name: 4-(3-but-2-ynoxy-4-methoxy-phenyl)-3-(1-hydroxyethyl)-3-methyl-pyrrolidine-1-carboxylic acid methyl ester Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=C(C=CC(=C1)C2CN(CC2(C)C(C)O)C(=O)OC)OC

Isomeric SMILES

CC#CCOC1=C(C=CC(=C1)C2CN(CC2(C)C(C)O)C(=O)OC)OC

InChI

InChI=1S/C20H27NO5/c1-6-7-10-26-18-11-15(8-9-17(18)24-4)16-12-21(19(23)25-5)13-20(16,3)14(2)22/h8-9,11,14,16,22H,10,12-13H2,1-5H3