(E)-N-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-(isopentylamino)-2-oxo-ethyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[2-(3-methylbutylamino)-2-oxoethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(3-methylbutylamino)-2-oxoethyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[2-(isoamylamino)-2-keto-ethyl]-3-(4-nitrophenyl)acrylamide Formula: C16H21N3O4 MolecularWeight: 319.35564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CNC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC(=O)CNC(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O4/c1-12(2)9-10-17-16(21)11-18-15(20)8-5-13-3-6-14(7-4-13)19(22)23/h3-8,12H,9-11H2,1-2H3,(H,17,21)(H,18,20)/b8-5+