(2R,3S,4S)-4-ethenyl-3-[(phenylmethyl)amino]heptan-2-ol

Systemtic Name: (2R,3S,4S)-4-ethenyl-3-[(phenylmethyl)amino]heptan-2-ol Openeye Name: (2R,3S,4S)-3-(benzylamino)-4-vinyl-heptan-2-ol CAS Name: (2R,3S,4S)-4-ethenyl-3-[(phenylmethyl)amino]-2-heptanol IUPAC Name: (2R,3S,4S)-3-(benzylamino)-4-ethenylheptan-2-ol Traditional Name: (2R,3S,4S)-3-(benzylamino)-4-propyl-hex-5-en-2-ol Formula: C16H25NO MolecularWeight: 247.3758

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C=C)C(C(C)O)NCC1=CC=CC=C1

Isomeric SMILES

CCC[C@@H](C=C)[C@@H]([C@@H](C)O)NCC1=CC=CC=C1

InChI

InChI=1S/C16H25NO/c1-4-9-15(5-2)16(13(3)18)17-12-14-10-7-6-8-11-14/h5-8,10-11,13,15-18H,2,4,9,12H2,1,3H3/t13-,15-,16-/m1/s1