2-[[4-(3-methylbutoxy)phenyl]methylazaniumyl]ethyl-methylsulfonyl-azanide

Systemtic Name: 2-[[4-(3-methylbutoxy)phenyl]methylazaniumyl]ethyl-methylsulfonyl-azanide Openeye Name: 2-[(4-isopentyloxyphenyl)methylammonio]ethyl-methylsulfonyl-azanide CAS Name: 2-[[4-(3-methylbutoxy)phenyl]methylammonio]ethyl-methylsulfonylazanide IUPAC Name: 2-[[4-(3-methylbutoxy)phenyl]methylazaniumyl]ethyl-methylsulfonylazanide Traditional Name: 2-[(4-isoamoxybenzyl)ammonio]ethyl-mesyl-azanide Formula: C15H26N2O3S MolecularWeight: 314.44354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C[NH2+]CC[N-]S(=O)(=O)C

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C[NH2+]CC[N-]S(=O)(=O)C

InChI

InChI=1S/C15H25N2O3S/c1-13(2)8-11-20-15-6-4-14(5-7-15)12-16-9-10-17-21(3,18)19/h4-7,13,16H,8-12H2,1-3H3/q-1/p+1