1-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-methanamine

Systemtic Name: 1-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-methanamine Openeye Name: 1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-methanamine CAS Name: 1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[(2-chloro-5-nitrophenyl)methyl]-N-methylmethanamine IUPAC Name: 1-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-[(2-chloro-5-nitrophenyl)methyl]-N-methylmethanamine Traditional Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-(2-chloro-5-nitro-benzyl)-methyl-amine Formula: C18H18Cl2N2O4 MolecularWeight: 397.25252

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C(=C1)Cl)OCCCO2)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CN(CC1=CC2=C(C(=C1)Cl)OCCCO2)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H18Cl2N2O4/c1-21(11-13-9-14(22(23)24)3-4-15(13)19)10-12-7-16(20)18-17(8-12)25-5-2-6-26-18/h3-4,7-9H,2,5-6,10-11H2,1H3