N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-3-nitro-benzamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-3-nitro-benzamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-3-nitro-benzamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-3-nitrobenzamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-3-nitrobenzamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-methyl-3-nitro-benzamide Formula: C17H15ClN2O5 MolecularWeight: 362.7644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2Cl)OCCCO3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2Cl)OCCCO3

InChI

InChI=1S/C17H15ClN2O5/c1-10-11(4-2-5-14(10)20(22)23)17(21)19-13-9-16-15(8-12(13)18)24-6-3-7-25-16/h2,4-5,8-9H,3,6-7H2,1H3,(H,19,21)