[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-[(2R)-5-methylhexan-2-yl]azanium

Systemtic Name: [2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-[(2R)-5-methylhexan-2-yl]azanium Openeye Name: [(1R)-1,4-dimethylpentyl]-[2-(3-methoxyanilino)-2-oxo-ethyl]ammonium CAS Name: [2-(3-methoxyanilino)-2-oxoethyl]-[(2R)-5-methylhexan-2-yl]ammonium IUPAC Name: [2-(3-methoxyanilino)-2-oxoethyl]-[(2R)-5-methylhexan-2-yl]azanium Traditional Name: [(1R)-1,4-dimethylpentyl]-[2-keto-2-(m-anisidino)ethyl]ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CC(=O)NC1=CC(=CC=C1)OC

Isomeric SMILES

C[C@H](CCC(C)C)[NH2+]CC(=O)NC1=CC(=CC=C1)OC

InChI

InChI=1S/C16H26N2O2/c1-12(2)8-9-13(3)17-11-16(19)18-14-6-5-7-15(10-14)20-4/h5-7,10,12-13,17H,8-9,11H2,1-4H3,(H,18,19)/p+1/t13-/m1/s1