N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-nitro-benzamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-nitro-benzamide Openeye Name: N-[(4S)-chroman-4-yl]-2-nitro-benzamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-2-nitrobenzamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-nitrobenzamide Traditional Name: N-[(4S)-chroman-4-yl]-2-nitro-benzamide Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1COC2=CC=CC=C2[C@H]1NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O4/c19-16(12-6-1-3-7-14(12)18(20)21)17-13-9-10-22-15-8-4-2-5-11(13)15/h1-8,13H,9-10H2,(H,17,19)/t13-/m0/s1