methyl (2S)-2-[[(1R,2R)-2-methylcyclohex-3-en-1-yl]amino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[(1R,2R)-2-methylcyclohex-3-en-1-yl]amino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[(1R,2R)-2-methylcyclohex-3-en-1-yl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[(1R,2R)-2-methyl-1-cyclohex-3-enyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[(1R,2R)-2-methylcyclohex-3-en-1-yl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[(1R,2R)-2-methylcyclohex-3-en-1-yl]amino]-2-phenyl-acetic acid methyl ester Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CCCC1NC(C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

C[C@@H]1C=CCC[C@H]1N[C@@H](C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H21NO2/c1-12-8-6-7-11-14(12)17-15(16(18)19-2)13-9-4-3-5-10-13/h3-6,8-10,12,14-15,17H,7,11H2,1-2H3/t12-,14-,15+/m1/s1