(2S)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: (2S)-2-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]-4H-1,4-benzoxazin-3-one Openeye Name: (2S)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-4H-1,4-benzoxazin-3-one CAS Name: (2S)-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: (2S)-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-4H-1,4-benzoxazin-3-one Traditional Name: (2S)-2-[2-keto-2-(4-phenylpiperazino)ethyl]-4H-1,4-benzoxazin-3-one Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CC3C(=O)NC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C[C@H]3C(=O)NC4=CC=CC=C4O3

InChI

InChI=1S/C20H21N3O3/c24-19(14-18-20(25)21-16-8-4-5-9-17(16)26-18)23-12-10-22(11-13-23)15-6-2-1-3-7-15/h1-9,18H,10-14H2,(H,21,25)/t18-/m0/s1