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

Systemtic Name: 1-[[2,2-dimethyl-6-nitro-4-(2-oxidanylidenepyrrolidin-1-yl)chromen-3-yl]methyl]-3-ethyl-1-methyl-urea Openeye Name: 1-[[2,2-dimethyl-6-nitro-4-(2-oxopyrrolidin-1-yl)chromen-3-yl]methyl]-3-ethyl-1-methyl-urea CAS Name: 1-[[2,2-dimethyl-6-nitro-4-(2-oxo-1-pyrrolidinyl)-1-benzopyran-3-yl]methyl]-3-ethyl-1-methylurea IUPAC Name: 1-[[2,2-dimethyl-6-nitro-4-(2-oxopyrrolidin-1-yl)chromen-3-yl]methyl]-3-ethyl-1-methylurea Traditional Name: 3-ethyl-1-[[4-(2-ketopyrrolidino)-2,2-dimethyl-6-nitro-chromen-3-yl]methyl]-1-methyl-urea Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(C)CC1=C(C2=C(C=CC(=C2)[N+](=O)[O-])OC1(C)C)N3CCCC3=O

Isomeric SMILES

CCNC(=O)N(C)CC1=C(C2=C(C=CC(=C2)[N+](=O)[O-])OC1(C)C)N3CCCC3=O

InChI

InChI=1S/C20H26N4O5/c1-5-21-19(26)22(4)12-15-18(23-10-6-7-17(23)25)14-11-13(24(27)28)8-9-16(14)29-20(15,2)3/h8-9,11H,5-7,10,12H2,1-4H3,(H,21,26)