N-(5-chloranyl-2-methyl-phenyl)-2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]acetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]acetamide Formula: C20H22ClN3O5 MolecularWeight: 419.85878

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C2C(=CC(=C1)[N+](=O)[O-])COCO2)CC(=O)NC3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CCN(CC1=C2C(=CC(=C1)[N+](=O)[O-])COCO2)CC(=O)NC3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C20H22ClN3O5/c1-3-23(10-19(25)22-18-8-16(21)5-4-13(18)2)9-14-6-17(24(26)27)7-15-11-28-12-29-20(14)15/h4-8H,3,9-12H2,1-2H3,(H,22,25)