2-[(2E)-6-azanyl-2-(furan-2-ylmethylidene)-3-oxidanylidene-1,4-benzoxazin-4-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2E)-6-azanyl-2-(furan-2-ylmethylidene)-3-oxidanylidene-1,4-benzoxazin-4-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(2E)-6-amino-2-(2-furylmethylene)-3-oxo-1,4-benzoxazin-4-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(2E)-6-amino-2-(2-furanylmethylidene)-3-oxo-1,4-benzoxazin-4-yl]ethyl-dimethylammonium IUPAC Name: 2-[(2E)-6-amino-2-(furan-2-ylmethylidene)-3-oxo-1,4-benzoxazin-4-yl]ethyl-dimethylazanium Traditional Name: 2-[(2E)-6-amino-2-(2-furfurylidene)-3-keto-1,4-benzoxazin-4-yl]ethyl-dimethyl-ammonium Formula: C17H20N3O3+ MolecularWeight: 314.359

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C2=C(C=CC(=C2)N)OC(=CC3=CC=CO3)C1=O

Isomeric SMILES

C[NH+](C)CCN1C2=C(C=CC(=C2)N)O/C(=C/C3=CC=CO3)/C1=O

InChI

InChI=1S/C17H19N3O3/c1-19(2)7-8-20-14-10-12(18)5-6-15(14)23-16(17(20)21)11-13-4-3-9-22-13/h3-6,9-11H,7-8,18H2,1-2H3/p+1/b16-11+