2-[(2S)-4-[3-(dimethylamino)propyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[(2S)-4-[3-(dimethylamino)propyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2S)-4-[3-(dimethylamino)propyl]-3-oxo-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2S)-4-[3-(dimethylamino)propyl]-3-oxo-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2S)-4-[3-(dimethylamino)propyl]-3-oxo-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2S)-4-[3-(dimethylamino)propyl]-3-keto-1,4-benzoxazin-2-yl]acetic acid Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2OC(C1=O)CC(=O)O

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2O[C@H](C1=O)CC(=O)O

InChI

InChI=1S/C15H20N2O4/c1-16(2)8-5-9-17-11-6-3-4-7-12(11)21-13(15(17)20)10-14(18)19/h3-4,6-7,13H,5,8-10H2,1-2H3,(H,18,19)/t13-/m0/s1