N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-chloranyl-4-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-chloranyl-4-nitro-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-chloro-4-nitro-benzamide CAS Name: N-[2-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenyl]-2-chloro-4-nitrobenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-chloro-4-nitrobenzamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylcarbamoyl)phenyl]-2-chloro-4-nitro-benzamide Formula: C21H14ClN3O6 MolecularWeight: 439.80536

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC=CC=C3NC(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H14ClN3O6/c22-16-10-13(25(28)29)6-7-14(16)20(26)24-17-4-2-1-3-15(17)21(27)23-12-5-8-18-19(9-12)31-11-30-18/h1-10H,11H2,(H,23,27)(H,24,26)