(2S)-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-methanoyl-2-nitro-phenoxy)propanamide

Systemtic Name: (2S)-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-methanoyl-2-nitro-phenoxy)propanamide Openeye Name: (2S)-2-(4-formyl-2-nitro-phenoxy)-N-[2-[(1S)-1-methylpropyl]phenyl]propanamide CAS Name: (2S)-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-formyl-2-nitrophenoxy)propanamide IUPAC Name: (2S)-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-formyl-2-nitrophenoxy)propanamide Traditional Name: (2S)-2-(4-formyl-2-nitro-phenoxy)-N-[2-[(1S)-1-methylpropyl]phenyl]propionamide Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1NC(=O)[C@H](C)OC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O5/c1-4-13(2)16-7-5-6-8-17(16)21-20(24)14(3)27-19-10-9-15(12-23)11-18(19)22(25)26/h5-14H,4H2,1-3H3,(H,21,24)/t13-,14-/m0/s1