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

Systemtic Name: N-[2-methyl-3-oxidanylidene-4-(2-piperidin-1-ylethyl)-1,4-benzoxazin-6-yl]-3,5-dinitro-benzamide Openeye Name: N-[2-methyl-3-oxo-4-[2-(1-piperidyl)ethyl]-1,4-benzoxazin-6-yl]-3,5-dinitro-benzamide CAS Name: N-[2-methyl-3-oxo-4-[2-(1-piperidinyl)ethyl]-1,4-benzoxazin-6-yl]-3,5-dinitrobenzamide IUPAC Name: N-[2-methyl-3-oxo-4-(2-piperidin-1-ylethyl)-1,4-benzoxazin-6-yl]-3,5-dinitrobenzamide Traditional Name: N-[3-keto-2-methyl-4-(2-piperidinoethyl)-1,4-benzoxazin-6-yl]-3,5-dinitro-benzamide Formula: C23H25N5O7 MolecularWeight: 483.4739

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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-])CCN4CCCCC4

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])CCN4CCCCC4

InChI

InChI=1S/C23H25N5O7/c1-15-23(30)26(10-9-25-7-3-2-4-8-25)20-13-17(5-6-21(20)35-15)24-22(29)16-11-18(27(31)32)14-19(12-16)28(33)34/h5-6,11-15H,2-4,7-10H2,1H3,(H,24,29)