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

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-4-(methylamino)-3-nitro-benzamide Openeye Name: N-[(4S)-chroman-4-yl]-4-(methylamino)-3-nitro-benzamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-4-(methylamino)-3-nitrobenzamide Traditional Name: N-[(4S)-chroman-4-yl]-4-(methylamino)-3-nitro-benzamide Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2CCOC3=CC=CC=C23)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N[C@H]2CCOC3=CC=CC=C23)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O4/c1-18-14-7-6-11(10-15(14)20(22)23)17(21)19-13-8-9-24-16-5-3-2-4-12(13)16/h2-7,10,13,18H,8-9H2,1H3,(H,19,21)/t13-/m0/s1