N-[4-[(2S)-butan-2-yl]phenyl]-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanamide

Systemtic Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanamide Openeye Name: 2-(2-allyl-4-nitro-phenoxy)-N-[4-[(1S)-1-methylpropyl]phenyl]acetamide CAS Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(4-nitro-2-prop-2-enylphenoxy)acetamide IUPAC Name: N-[4-[(2S)-butan-2-yl]phenyl]-2-(4-nitro-2-prop-2-enylphenoxy)acetamide Traditional Name: 2-(2-allyl-4-nitro-phenoxy)-N-[4-[(1S)-1-methylpropyl]phenyl]acetamide Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])CC=C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])CC=C

InChI

InChI=1S/C21H24N2O4/c1-4-6-17-13-19(23(25)26)11-12-20(17)27-14-21(24)22-18-9-7-16(8-10-18)15(3)5-2/h4,7-13,15H,1,5-6,14H2,2-3H3,(H,22,24)/t15-/m0/s1