2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(1-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(1-thiophen-2-ylethyl)ethanamide Openeye Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-[1-(2-thienyl)ethyl]acetamide CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(1-thiophen-2-ylethyl)acetamide IUPAC Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-N-(1-thiophen-2-ylethyl)acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-[1-(2-thienyl)ethyl]acetamide Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5S/c1-10(14-3-2-6-25-14)17-15(20)8-18-12-7-11(19(22)23)4-5-13(12)24-9-16(18)21/h2-7,10H,8-9H2,1H3,(H,17,20)