[2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: [2-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: [2-(4-chloro-2-methoxy-5-methyl-anilino)-2-oxo-ethyl]-methyl-[(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]-methyl-[(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]-methyl-[(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: [2-(4-chloro-2-methoxy-5-methyl-anilino)-2-keto-ethyl]-methyl-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C16H22ClN4O2+ MolecularWeight: 337.82448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C[NH+](C)CC2=CN(N=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C[NH+](C)CC2=CN(N=C2)C

InChI

InChI=1S/C16H21ClN4O2/c1-11-5-14(15(23-4)6-13(11)17)19-16(22)10-20(2)8-12-7-18-21(3)9-12/h5-7,9H,8,10H2,1-4H3,(H,19,22)/p+1