N-[4-(2-dimethylaminoethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-(2-dimethylaminoethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]-3,5-dinitro-benzamide Openeye Name: N-[4-(2-dimethylaminoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-3,5-dinitro-benzamide CAS Name: N-[4-(2-dimethylaminoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-3,5-dinitrobenzamide IUPAC Name: N-[4-(2-dimethylaminoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]-3,5-dinitrobenzamide Traditional Name: N-[4-(2-dimethylaminoethyl)-3-keto-2-methyl-1,4-benzoxazin-6-yl]-3,5-dinitro-benzamide Formula: C20H21N5O7 MolecularWeight: 443.41004

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])CCN(C)C

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])CCN(C)C

InChI

InChI=1S/C20H21N5O7/c1-12-20(27)23(7-6-22(2)3)17-10-14(4-5-18(17)32-12)21-19(26)13-8-15(24(28)29)11-16(9-13)25(30)31/h4-5,8-12H,6-7H2,1-3H3,(H,21,26)