(3S)-3-[(4R)-2,2-dimethyloxan-4-yl]-3-(3-phenylpropanoylamino)propanoate

Systemtic Name: (3S)-3-[(4R)-2,2-dimethyloxan-4-yl]-3-(3-phenylpropanoylamino)propanoate Openeye Name: (3S)-3-[(4R)-2,2-dimethyltetrahydropyran-4-yl]-3-(3-phenylpropanoylamino)propanoate CAS Name: (3S)-3-[(4R)-2,2-dimethyl-4-oxanyl]-3-[(1-oxo-3-phenylpropyl)amino]propanoate IUPAC Name: (3S)-3-[(4R)-2,2-dimethyloxan-4-yl]-3-(3-phenylpropanoylamino)propanoate Traditional Name: (3S)-3-[(4R)-2,2-dimethyltetrahydropyran-4-yl]-3-(hydrocinnamoylamino)propionate Formula: C19H26NO4- MolecularWeight: 332.41404

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)C(CC(=O)[O-])NC(=O)CCC2=CC=CC=C2)C

Isomeric SMILES

CC1(C[C@@H](CCO1)[C@H](CC(=O)[O-])NC(=O)CCC2=CC=CC=C2)C

InChI

InChI=1S/C19H27NO4/c1-19(2)13-15(10-11-24-19)16(12-18(22)23)20-17(21)9-8-14-6-4-3-5-7-14/h3-7,15-16H,8-13H2,1-2H3,(H,20,21)(H,22,23)/p-1/t15-,16+/m1/s1