methyl 2-[[(3S,4S)-4-methylhex-5-en-3-yl]-[(1R)-1-phenylethyl]amino]ethanoate

Systemtic Name: methyl 2-[[(3S,4S)-4-methylhex-5-en-3-yl]-[(1R)-1-phenylethyl]amino]ethanoate Openeye Name: methyl 2-[[(1S,2S)-1-ethyl-2-methyl-but-3-enyl]-[(1R)-1-phenylethyl]amino]acetate CAS Name: 2-[[(3S,4S)-4-methylhex-5-en-3-yl]-[(1R)-1-phenylethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(3S,4S)-4-methylhex-5-en-3-yl]-[(1R)-1-phenylethyl]amino]acetate Traditional Name: 2-[[(1S,2S)-1-ethyl-2-methyl-but-3-enyl]-[(1R)-1-phenylethyl]amino]acetic acid methyl ester Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C=C)N(CC(=O)OC)C(C)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO2/c1-6-14(3)17(7-2)19(13-18(20)21-5)15(4)16-11-9-8-10-12-16/h6,8-12,14-15,17H,1,7,13H2,2-5H3/t14-,15+,17-/m0/s1