N-(6-chloranyl-1,3-benzodioxol-5-yl)-4-[(2-nitrophenyl)amino]butanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-4-[(2-nitrophenyl)amino]butanamide Openeye Name: N-(6-chloro-1,3-benzodioxol-5-yl)-4-(2-nitroanilino)butanamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-4-(2-nitroanilino)butanamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-4-(2-nitroanilino)butanamide Traditional Name: N-(6-chloro-1,3-benzodioxol-5-yl)-4-(2-nitroanilino)butyramide Formula: C17H16ClN3O5 MolecularWeight: 377.77904

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)NC(=O)CCCNC3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)NC(=O)CCCNC3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C17H16ClN3O5/c18-11-8-15-16(26-10-25-15)9-13(11)20-17(22)6-3-7-19-12-4-1-2-5-14(12)21(23)24/h1-2,4-5,8-9,19H,3,6-7,10H2,(H,20,22)