N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanamide

Systemtic Name: N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)ethanamide Openeye Name: N-[(1S)-1-(4-isobutylphenyl)ethyl]-2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide CAS Name: N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide IUPAC Name: N-[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]-2-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)acetamide Traditional Name: N-[(1S)-1-(4-isobutylphenyl)ethyl]-2-(2-keto-6-nitro-1,3-benzoxazol-3-yl)acetamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)CC(C)C)NC(=O)CN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C21H23N3O5/c1-13(2)10-15-4-6-16(7-5-15)14(3)22-20(25)12-23-18-9-8-17(24(27)28)11-19(18)29-21(23)26/h4-9,11,13-14H,10,12H2,1-3H3,(H,22,25)/t14-/m0/s1