[3-chloranyl-4-(3-methylbutoxy)phenyl]methyl-bis(2-chloroethyl)azanium

Systemtic Name: [3-chloranyl-4-(3-methylbutoxy)phenyl]methyl-bis(2-chloroethyl)azanium Openeye Name: bis(2-chloroethyl)-[(3-chloro-4-isopentyloxy-phenyl)methyl]ammonium CAS Name: bis(2-chloroethyl)-[[3-chloro-4-(3-methylbutoxy)phenyl]methyl]ammonium IUPAC Name: bis(2-chloroethyl)-[[3-chloro-4-(3-methylbutoxy)phenyl]methyl]azanium Traditional Name: bis(2-chloroethyl)-(3-chloro-4-isoamoxy-benzyl)ammonium Formula: C16H25Cl3NO+ MolecularWeight: 353.7348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C[NH+](CCCl)CCCl)Cl

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C[NH+](CCCl)CCCl)Cl

InChI

InChI=1S/C16H24Cl3NO/c1-13(2)5-10-21-16-4-3-14(11-15(16)19)12-20(8-6-17)9-7-18/h3-4,11,13H,5-10,12H2,1-2H3/p+1