N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-keto-propyl]-4-nitro-benzamide Formula: C18H17N3O6 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O6/c22-17(20-13-3-6-15-16(11-13)27-10-9-26-15)7-8-19-18(23)12-1-4-14(5-2-12)21(24)25/h1-6,11H,7-10H2,(H,19,23)(H,20,22)