(2S)-2-[2-(5,5-dimethyl-1,3-dioxan-2-yl)ethylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[2-(5,5-dimethyl-1,3-dioxan-2-yl)ethylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[2-(5,5-dimethyl-1,3-dioxan-2-yl)ethylamino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[2-(5,5-dimethyl-1,3-dioxan-2-yl)ethylamino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[2-(5,5-dimethyl-1,3-dioxan-2-yl)ethylamino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[2-(5,5-dimethyl-1,3-dioxan-2-yl)ethylamino]-3-phenyl-propionic acid Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)CCNC(CC2=CC=CC=C2)C(=O)O)C

Isomeric SMILES

CC1(COC(OC1)CCN[C@@H](CC2=CC=CC=C2)C(=O)O)C

InChI

InChI=1S/C17H25NO4/c1-17(2)11-21-15(22-12-17)8-9-18-14(16(19)20)10-13-6-4-3-5-7-13/h3-7,14-15,18H,8-12H2,1-2H3,(H,19,20)/t14-/m0/s1