(3-ethoxyphenyl)methyl-[(1R)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]azanium

Systemtic Name: (3-ethoxyphenyl)methyl-[(1R)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]azanium Openeye Name: (3-ethoxyphenyl)methyl-[(1R)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]ammonium CAS Name: (3-ethoxyphenyl)methyl-[(1R)-1-(5-methyl-1-phenyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: (3-ethoxyphenyl)methyl-[(1R)-1-(5-methyl-1-phenylpyrazol-4-yl)ethyl]azanium Traditional Name: (3-ethoxybenzyl)-[(1R)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]ammonium Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C[NH2+]C(C)C2=C(N(N=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC1=CC=CC(=C1)C[NH2+][C@H](C)C2=C(N(N=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H25N3O/c1-4-25-20-12-8-9-18(13-20)14-22-16(2)21-15-23-24(17(21)3)19-10-6-5-7-11-19/h5-13,15-16,22H,4,14H2,1-3H3/p+1/t16-/m1/s1