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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)NCCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)NCCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H22ClN3O5/c1-23(12-15-11-16(24(26)27)3-4-17(15)21)13-20(25)22-7-6-14-2-5-18-19(10-14)29-9-8-28-18/h2-5,10-11H,6-9,12-13H2,1H3,(H,22,25)