4-(2-diethylaminoethyl)-7-nitro-2-phenyl-1,4-benzothiazin-3-one

Systemtic Name: 4-(2-diethylaminoethyl)-7-nitro-2-phenyl-1,4-benzothiazin-3-one Openeye Name: 4-(2-diethylaminoethyl)-7-nitro-2-phenyl-1,4-benzothiazin-3-one CAS Name: 4-(2-diethylaminoethyl)-7-nitro-2-phenyl-1,4-benzothiazin-3-one IUPAC Name: 4-(2-diethylaminoethyl)-7-nitro-2-phenyl-1,4-benzothiazin-3-one Traditional Name: 4-(2-diethylaminoethyl)-7-nitro-2-phenyl-1,4-benzothiazin-3-one Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC(C1=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC(C1=O)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3O3S/c1-3-21(4-2)12-13-22-17-11-10-16(23(25)26)14-18(17)27-19(20(22)24)15-8-6-5-7-9-15/h5-11,14,19H,3-4,12-13H2,1-2H3