(E)-N-[(2S)-heptan-2-yl]-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2S)-heptan-2-yl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[(1S)-1-methylhexyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(2S)-heptan-2-yl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(2S)-heptan-2-yl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(1S)-1-methylhexyl]-3-(4-nitrophenyl)acrylamide Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C=CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCC[C@H](C)NC(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H22N2O3/c1-3-4-5-6-13(2)17-16(19)12-9-14-7-10-15(11-8-14)18(20)21/h7-13H,3-6H2,1-2H3,(H,17,19)/b12-9+/t13-/m0/s1