methyl (2S)-2-[[(4R)-3,3-dimethylocta-1,7-dien-4-yl]amino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[(4R)-3,3-dimethylocta-1,7-dien-4-yl]amino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[(1R)-1-(1,1-dimethylallyl)pent-4-enyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[(4R)-3,3-dimethylocta-1,7-dien-4-yl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[(4R)-3,3-dimethylocta-1,7-dien-4-yl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[(1R)-1-(1,1-dimethylallyl)pent-4-enyl]amino]-2-phenyl-acetic acid methyl ester Formula: C19H27NO2 MolecularWeight: 301.42318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO2/c1-6-8-14-16(19(3,4)7-2)20-17(18(21)22-5)15-12-10-9-11-13-15/h6-7,9-13,16-17,20H,1-2,8,14H2,3-5H3/t16-,17+/m1/s1