(3-chloranyl-1-benzothiophen-2-yl)methyl 2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 2-(3-oxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzoxazin-4-yl)acetic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 2-(3-oxo-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzoxazin-4-yl)acetic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C19H14ClNO4S MolecularWeight: 387.83676

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2O1)CC(=O)OCC3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2O1)CC(=O)OCC3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C19H14ClNO4S/c20-19-12-5-1-4-8-15(12)26-16(19)10-25-18(23)9-21-13-6-2-3-7-14(13)24-11-17(21)22/h1-8H,9-11H2