(2S)-2-[3-[4-(2-dimethylaminoethyloxy)phenyl]propanoylamino]propanoic acid

Systemtic Name: (2S)-2-[3-[4-(2-dimethylaminoethyloxy)phenyl]propanoylamino]propanoic acid Openeye Name: (2S)-2-[3-[4-(2-dimethylaminoethyloxy)phenyl]propanoylamino]propanoic acid CAS Name: (2S)-2-[[3-[4-(2-dimethylaminoethyloxy)phenyl]-1-oxopropyl]amino]propanoic acid IUPAC Name: (2S)-2-[3-[4-(2-dimethylaminoethyloxy)phenyl]propanoylamino]propanoic acid Traditional Name: (2S)-2-[3-[4-(2-dimethylaminoethyloxy)phenyl]propanoylamino]propionic acid Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CCC1=CC=C(C=C1)OCCN(C)C

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)CCC1=CC=C(C=C1)OCCN(C)C

InChI

InChI=1S/C16H24N2O4/c1-12(16(20)21)17-15(19)9-6-13-4-7-14(8-5-13)22-11-10-18(2)3/h4-5,7-8,12H,6,9-11H2,1-3H3,(H,17,19)(H,20,21)/t12-/m0/s1