4-chloranyl-N-(4-methoxybutan-2-yl)-3-(methoxymethyl)-2,6-dinitro-aniline

Systemtic Name: 4-chloranyl-N-(4-methoxybutan-2-yl)-3-(methoxymethyl)-2,6-dinitro-aniline Openeye Name: 4-chloro-3-(methoxymethyl)-N-(3-methoxy-1-methyl-propyl)-2,6-dinitro-aniline CAS Name: 4-chloro-N-(4-methoxybutan-2-yl)-3-(methoxymethyl)-2,6-dinitroaniline IUPAC Name: 4-chloro-N-(4-methoxybutan-2-yl)-3-(methoxymethyl)-2,6-dinitroaniline Traditional Name: [4-chloro-3-(methoxymethyl)-2,6-dinitro-phenyl]-(3-methoxy-1-methyl-propyl)amine Formula: C13H18ClN3O6 MolecularWeight: 347.75152

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC)NC1=C(C(=C(C=C1[N+](=O)[O-])Cl)COC)[N+](=O)[O-]

Isomeric SMILES

CC(CCOC)NC1=C(C(=C(C=C1[N+](=O)[O-])Cl)COC)[N+](=O)[O-]

InChI

InChI=1S/C13H18ClN3O6/c1-8(4-5-22-2)15-12-11(16(18)19)6-10(14)9(7-23-3)13(12)17(20)21/h6,8,15H,4-5,7H2,1-3H3