[2-[2-[(2S)-butan-2-yl]phenoxy]-6-chloranyl-phenyl]methylazanium

Systemtic Name: [2-[2-[(2S)-butan-2-yl]phenoxy]-6-chloranyl-phenyl]methylazanium Openeye Name: [2-chloro-6-[2-[(1S)-1-methylpropyl]phenoxy]phenyl]methylammonium CAS Name: [2-[2-[(2S)-butan-2-yl]phenoxy]-6-chlorophenyl]methylammonium IUPAC Name: [2-[2-[(2S)-butan-2-yl]phenoxy]-6-chlorophenyl]methylazanium Traditional Name: [2-chloro-6-[2-[(1S)-1-methylpropyl]phenoxy]benzyl]ammonium Formula: C17H21ClNO+ MolecularWeight: 290.80774

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OC2=C(C(=CC=C2)Cl)C[NH3+]

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OC2=C(C(=CC=C2)Cl)C[NH3+]

InChI

InChI=1S/C17H20ClNO/c1-3-12(2)13-7-4-5-9-16(13)20-17-10-6-8-15(18)14(17)11-19/h4-10,12H,3,11,19H2,1-2H3/p+1/t12-/m0/s1