1,3-benzoxazol-2-ylmethyl-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]azanium

Systemtic Name: 1,3-benzoxazol-2-ylmethyl-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]azanium Openeye Name: 1,3-benzoxazol-2-ylmethyl-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]ammonium CAS Name: 1,3-benzoxazol-2-ylmethyl-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]ammonium IUPAC Name: 1,3-benzoxazol-2-ylmethyl-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]azanium Traditional Name: 1,3-benzoxazol-2-ylmethyl-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]ammonium Formula: C18H21N2O2+ MolecularWeight: 297.37154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)[NH2+]CC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)[NH2+]CC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C18H20N2O2/c1-12-8-9-16(21-3)14(10-12)13(2)19-11-18-20-15-6-4-5-7-17(15)22-18/h4-10,13,19H,11H2,1-3H3/p+1/t13-/m0/s1