3-oxidanylidene-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazine-7-carboxylate

Systemtic Name: 3-oxidanylidene-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazine-7-carboxylate Openeye Name: 3-oxo-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazine-7-carboxylate CAS Name: 3-oxo-4-[2-(1-piperidin-1-iumyl)ethyl]-1,4-benzoxazine-7-carboxylate IUPAC Name: 3-oxo-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazine-7-carboxylate Traditional Name: 3-keto-4-(2-piperidin-1-ium-1-ylethyl)-1,4-benzoxazine-7-carboxylate Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C(=O)COC3=C2C=CC(=C3)C(=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CCN2C(=O)COC3=C2C=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C16H20N2O4/c19-15-11-22-14-10-12(16(20)21)4-5-13(14)18(15)9-8-17-6-2-1-3-7-17/h4-5,10H,1-3,6-9,11H2,(H,20,21)