(phenylmethyl) (2R,4S)-4-methyl-4-oxidanyl-2-pent-4-enyl-2,3-dihydropyridine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R,4S)-4-methyl-4-oxidanyl-2-pent-4-enyl-2,3-dihydropyridine-1-carboxylate Openeye Name: benzyl (2R,4S)-4-hydroxy-4-methyl-2-pent-4-enyl-2,3-dihydropyridine-1-carboxylate CAS Name: (2R,4S)-4-hydroxy-4-methyl-2-pent-4-enyl-2,3-dihydropyridine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,4S)-4-hydroxy-4-methyl-2-pent-4-enyl-2,3-dihydropyridine-1-carboxylate Traditional Name: (2R,4S)-4-hydroxy-4-methyl-2-pent-4-enyl-2,3-dihydropyridine-1-carboxylic acid benzyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(N(C=C1)C(=O)OCC2=CC=CC=C2)CCCC=C)O

Isomeric SMILES

C[C@@]1(C[C@H](N(C=C1)C(=O)OCC2=CC=CC=C2)CCCC=C)O

InChI

InChI=1S/C19H25NO3/c1-3-4-6-11-17-14-19(2,22)12-13-20(17)18(21)23-15-16-9-7-5-8-10-16/h3,5,7-10,12-13,17,22H,1,4,6,11,14-15H2,2H3/t17-,19-/m1/s1