(E)-N-[4-[(2S)-butan-2-yl]-2-oxidanyl-phenyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-[(2S)-butan-2-yl]-2-oxidanyl-phenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[2-hydroxy-4-[(1S)-1-methylpropyl]phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[4-[(2S)-butan-2-yl]-2-hydroxyphenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[4-[(2S)-butan-2-yl]-2-hydroxyphenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[2-hydroxy-4-[(1S)-1-methylpropyl]phenyl]-3-(3-nitrophenyl)acrylamide Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

CC[C@H](C)C1=CC(=C(C=C1)NC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C19H20N2O4/c1-3-13(2)15-8-9-17(18(22)12-15)20-19(23)10-7-14-5-4-6-16(11-14)21(24)25/h4-13,22H,3H2,1-2H3,(H,20,23)/b10-7+/t13-/m0/s1