N-methyl-3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-prop-2-ynyl-benzamide

Systemtic Name: N-methyl-3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-prop-2-ynyl-benzamide Openeye Name: N-methyl-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]-N-prop-2-ynyl-benzamide CAS Name: N-methyl-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]-N-prop-2-ynylbenzamide IUPAC Name: N-methyl-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-prop-2-ynylbenzamide Traditional Name: 4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-N-methyl-3-nitro-N-propargyl-benzamide Formula: C24H24N4O5 MolecularWeight: 448.47116

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#C)C(=O)C1=CC(=C(C=C1)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)[N+](=O)[O-]

Isomeric SMILES

CN(CC#C)C(=O)C1=CC(=C(C=C1)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)[N+](=O)[O-]

InChI

InChI=1S/C24H24N4O5/c1-3-12-25(2)23(29)17-8-9-21(22(15-17)28(31)32)26-13-10-19(11-14-26)27-20-7-5-4-6-18(20)16-33-24(27)30/h1,4-9,15,19H,10-14,16H2,2H3