6-nitro-N-[2-(phenylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 6-nitro-N-[2-(phenylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-(2-benzylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 6-nitro-N-[2-(phenylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-(2-benzylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(2-benzylphenyl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3CC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3CC4=CC=CC=C4

InChI

InChI=1S/C22H18N2O5/c25-22(17-13-20-21(29-11-10-28-20)14-19(17)24(26)27)23-18-9-5-4-8-16(18)12-15-6-2-1-3-7-15/h1-9,13-14H,10-12H2,(H,23,25)