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

Systemtic Name: 6-chloranyl-4-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-(4-benzoylpiperazin-1-yl)-2-oxo-ethyl]-6-chloro-1,4-benzoxazin-3-one CAS Name: 4-[2-(4-benzoyl-1-piperazinyl)-2-oxoethyl]-6-chloro-1,4-benzoxazin-3-one IUPAC Name: 4-[2-(4-benzoylpiperazin-1-yl)-2-oxoethyl]-6-chloro-1,4-benzoxazin-3-one Traditional Name: 4-[2-(4-benzoylpiperazino)-2-keto-ethyl]-6-chloro-1,4-benzoxazin-3-one Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20ClN3O4/c22-16-6-7-18-17(12-16)25(20(27)14-29-18)13-19(26)23-8-10-24(11-9-23)21(28)15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2