4-(1,3-dioxan-2-yl)-2-[(phenylmethyl)amino]butanoic acid

Systemtic Name: 4-(1,3-dioxan-2-yl)-2-[(phenylmethyl)amino]butanoic acid Openeye Name: 2-(benzylamino)-4-(1,3-dioxan-2-yl)butanoic acid CAS Name: 4-(1,3-dioxan-2-yl)-2-[(phenylmethyl)amino]butanoic acid IUPAC Name: 2-(benzylamino)-4-(1,3-dioxan-2-yl)butanoic acid Traditional Name: 2-(benzylamino)-4-(1,3-dioxan-2-yl)butyric acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(OC1)CCC(C(=O)O)NCC2=CC=CC=C2

Isomeric SMILES

C1COC(OC1)CCC(C(=O)O)NCC2=CC=CC=C2

InChI

InChI=1S/C15H21NO4/c17-15(18)13(7-8-14-19-9-4-10-20-14)16-11-12-5-2-1-3-6-12/h1-3,5-6,13-14,16H,4,7-11H2,(H,17,18)