ethyl 2-(4-azanyl-3-nitro-phenyl)carbonyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylate

Systemtic Name: ethyl 2-(4-azanyl-3-nitro-phenyl)carbonyl-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylate Openeye Name: ethyl 2-(4-amino-3-nitro-benzoyl)-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylate CAS Name: 2-[(4-amino-3-nitrophenyl)-oxomethyl]-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-amino-3-nitrobenzoyl)-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylate Traditional Name: 2-(4-amino-3-nitro-benzoyl)-5,6,7,8-tetrahydro-4H-1,4-benzothiazine-3-carboxylic acid ethyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C(N1)CCCC2)C(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC2=C(N1)CCCC2)C(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-2-26-18(23)15-17(27-14-6-4-3-5-12(14)20-15)16(22)10-7-8-11(19)13(9-10)21(24)25/h7-9,20H,2-6,19H2,1H3