(2S)-1-(3,4-dimethylphenyl)-2-(2-nitrophenoxy)propan-1-one

Systemtic Name: (2S)-1-(3,4-dimethylphenyl)-2-(2-nitrophenoxy)propan-1-one Openeye Name: (2S)-1-(3,4-dimethylphenyl)-2-(2-nitrophenoxy)propan-1-one CAS Name: (2S)-1-(3,4-dimethylphenyl)-2-(2-nitrophenoxy)-1-propanone IUPAC Name: (2S)-1-(3,4-dimethylphenyl)-2-(2-nitrophenoxy)propan-1-one Traditional Name: (2S)-1-(3,4-dimethylphenyl)-2-(2-nitrophenoxy)propan-1-one Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO4/c1-11-8-9-14(10-12(11)2)17(19)13(3)22-16-7-5-4-6-15(16)18(20)21/h4-10,13H,1-3H3/t13-/m0/s1