3-(5-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)propanamide

Systemtic Name: 3-(5-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)propanamide Openeye Name: 3-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)propanamide CAS Name: 3-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-[3-(4-morpholin-4-iumyl)propyl]propanamide IUPAC Name: 3-(5-chloro-2-oxo-1,3-benzoxazol-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)propanamide Traditional Name: 3-(5-chloro-2-keto-1,3-benzoxazol-3-yl)-N-(3-morpholin-4-ium-4-ylpropyl)propionamide Formula: C17H23ClN3O4+ MolecularWeight: 368.83522

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)CCN2C3=C(C=CC(=C3)Cl)OC2=O

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)CCN2C3=C(C=CC(=C3)Cl)OC2=O

InChI

InChI=1S/C17H22ClN3O4/c18-13-2-3-15-14(12-13)21(17(23)25-15)7-4-16(22)19-5-1-6-20-8-10-24-11-9-20/h2-3,12H,1,4-11H2,(H,19,22)/p+1