methyl (2R,4R)-4-phenyl-2-(pyrrolidin-1-ylmethyl)-2,3-dihydrochromene-4-carboxylate

Systemtic Name: methyl (2R,4R)-4-phenyl-2-(pyrrolidin-1-ylmethyl)-2,3-dihydrochromene-4-carboxylate Openeye Name: methyl (2R,4R)-4-phenyl-2-(pyrrolidin-1-ylmethyl)chromane-4-carboxylate CAS Name: (2R,4R)-4-phenyl-2-(1-pyrrolidinylmethyl)-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid methyl ester IUPAC Name: methyl (2R,4R)-4-phenyl-2-(pyrrolidin-1-ylmethyl)-2,3-dihydrochromene-4-carboxylate Traditional Name: (2R,4R)-4-phenyl-2-(pyrrolidinomethyl)chroman-4-carboxylic acid methyl ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC(OC2=CC=CC=C21)CN3CCCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@]1(C[C@@H](OC2=CC=CC=C21)CN3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H25NO3/c1-25-21(24)22(17-9-3-2-4-10-17)15-18(16-23-13-7-8-14-23)26-20-12-6-5-11-19(20)22/h2-6,9-12,18H,7-8,13-16H2,1H3/t18-,22-/m1/s1