6-chloranyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-chloranyl-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-chloro-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 6-chloro-4-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-chloro-4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 6-chloro-4-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-1,4-benzoxazin-3-one Formula: C15H19ClN3O3+ MolecularWeight: 324.78266

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C15H18ClN3O3/c1-17-4-6-18(7-5-17)14(20)9-19-12-8-11(16)2-3-13(12)22-10-15(19)21/h2-3,8H,4-7,9-10H2,1H3/p+1