methyl N-[[2,2-dimethyl-6-nitro-4-(2-oxidanylidenepyrrolidin-1-yl)chromen-3-yl]methyl]carbamate

Systemtic Name: methyl N-[[2,2-dimethyl-6-nitro-4-(2-oxidanylidenepyrrolidin-1-yl)chromen-3-yl]methyl]carbamate Openeye Name: methyl N-[[2,2-dimethyl-6-nitro-4-(2-oxopyrrolidin-1-yl)chromen-3-yl]methyl]carbamate CAS Name: N-[[2,2-dimethyl-6-nitro-4-(2-oxo-1-pyrrolidinyl)-1-benzopyran-3-yl]methyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2,2-dimethyl-6-nitro-4-(2-oxopyrrolidin-1-yl)chromen-3-yl]methyl]carbamate Traditional Name: N-[[4-(2-ketopyrrolidino)-2,2-dimethyl-6-nitro-chromen-3-yl]methyl]carbamic acid methyl ester Formula: C18H21N3O6 MolecularWeight: 375.37584

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3CCCC3=O)CNC(=O)OC)C

Isomeric SMILES

CC1(C(=C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])N3CCCC3=O)CNC(=O)OC)C

InChI

InChI=1S/C18H21N3O6/c1-18(2)13(10-19-17(23)26-3)16(20-8-4-5-15(20)22)12-9-11(21(24)25)6-7-14(12)27-18/h6-7,9H,4-5,8,10H2,1-3H3,(H,19,23)