(E)-N-methyl-N-[(2-nitrophenyl)methyl]-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-methyl-N-[(2-nitrophenyl)methyl]-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-N-methyl-N-[(2-nitrophenyl)methyl]-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-N-methyl-N-[(2-nitrophenyl)methyl]-3-[4-(2-oxo-1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-N-methyl-N-[(2-nitrophenyl)methyl]-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-[4-(2-ketopyrrolidino)phenyl]-N-methyl-N-(2-nitrobenzyl)acrylamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C=CC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)/C=C/C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C21H21N3O4/c1-22(15-17-5-2-3-6-19(17)24(27)28)20(25)13-10-16-8-11-18(12-9-16)23-14-4-7-21(23)26/h2-3,5-6,8-13H,4,7,14-15H2,1H3/b13-10+