methyl (3S)-3-[2,2-dimethylpropyl-[(1S)-1-phenylethyl]amino]butanoate

Systemtic Name: methyl (3S)-3-[2,2-dimethylpropyl-[(1S)-1-phenylethyl]amino]butanoate Openeye Name: methyl (3S)-3-[2,2-dimethylpropyl-[(1S)-1-phenylethyl]amino]butanoate CAS Name: (3S)-3-[2,2-dimethylpropyl-[(1S)-1-phenylethyl]amino]butanoic acid methyl ester IUPAC Name: methyl (3S)-3-[2,2-dimethylpropyl-[(1S)-1-phenylethyl]amino]butanoate Traditional Name: (3S)-3-[neopentyl-[(1S)-1-phenylethyl]amino]butyric acid methyl ester Formula: C18H29NO2 MolecularWeight: 291.42836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29NO2/c1-14(12-17(20)21-6)19(13-18(3,4)5)15(2)16-10-8-7-9-11-16/h7-11,14-15H,12-13H2,1-6H3/t14-,15-/m0/s1