N-[3-[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]oxyphenyl]-3-nitro-benzamide

Systemtic Name: N-[3-[(2S)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl]oxyphenyl]-3-nitro-benzamide Openeye Name: N-[3-[(1S)-1-methyl-2-oxo-2-(p-tolyl)ethoxy]phenyl]-3-nitro-benzamide CAS Name: N-[3-[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]oxyphenyl]-3-nitrobenzamide IUPAC Name: N-[3-[(2S)-1-(4-methylphenyl)-1-oxopropan-2-yl]oxyphenyl]-3-nitrobenzamide Traditional Name: N-[3-[(1S)-2-keto-1-methyl-2-(p-tolyl)ethoxy]phenyl]-3-nitro-benzamide Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C)OC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N2O5/c1-15-9-11-17(12-10-15)22(26)16(2)30-21-8-4-6-19(14-21)24-23(27)18-5-3-7-20(13-18)25(28)29/h3-14,16H,1-2H3,(H,24,27)/t16-/m0/s1