(3S)-N-methyl-N-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]-3-[(E)-prop-1-enyl]heptanamide

Systemtic Name: (3S)-N-methyl-N-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]-3-[(E)-prop-1-enyl]heptanamide Openeye Name: (3S)-N-[(1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-N-methyl-3-[(E)-prop-1-enyl]heptanamide CAS Name: (3S)-N-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-N-methyl-3-[(E)-prop-1-enyl]heptanamide IUPAC Name: (3S)-N-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-N-methyl-3-[(E)-prop-1-enyl]heptanamide Traditional Name: (E,3S)-3-butyl-N-[(1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-N-methyl-hex-4-enamide Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)N(C)C(C)C(C1=CC=CC=C1)O)C=CC

Isomeric SMILES

CCCC[C@@H](CC(=O)N(C)[C@@H](C)[C@H](C1=CC=CC=C1)O)/C=C/C

InChI

InChI=1S/C20H31NO2/c1-5-7-12-17(11-6-2)15-19(22)21(4)16(3)20(23)18-13-9-8-10-14-18/h6,8-11,13-14,16-17,20,23H,5,7,12,15H2,1-4H3/b11-6+/t16-,17-,20+/m0/s1