4-(3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-piperidin-1-ium-1-ylethyl)butanamide

Systemtic Name: 4-(3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-piperidin-1-ium-1-ylethyl)butanamide Openeye Name: 4-(3-oxo-1,4-benzoxazin-4-yl)-N-(2-piperidin-1-ium-1-ylethyl)butanamide CAS Name: 4-(3-oxo-1,4-benzoxazin-4-yl)-N-[2-(1-piperidin-1-iumyl)ethyl]butanamide IUPAC Name: 4-(3-oxo-1,4-benzoxazin-4-yl)-N-(2-piperidin-1-ium-1-ylethyl)butanamide Traditional Name: 4-(3-keto-1,4-benzoxazin-4-yl)-N-(2-piperidin-1-ium-1-ylethyl)butyramide Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)CCCN2C(=O)COC3=CC=CC=C32

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)CCCN2C(=O)COC3=CC=CC=C32

InChI

InChI=1S/C19H27N3O3/c23-18(20-10-14-21-11-4-1-5-12-21)9-6-13-22-16-7-2-3-8-17(16)25-15-19(22)24/h2-3,7-8H,1,4-6,9-15H2,(H,20,23)/p+1