[3-[[(2R)-2-(4-methylpentoxy)propanoyl]amino]phenyl]methylazanium

Systemtic Name: [3-[[(2R)-2-(4-methylpentoxy)propanoyl]amino]phenyl]methylazanium Openeye Name: [3-[[(2R)-2-isohexyloxypropanoyl]amino]phenyl]methylammonium CAS Name: [3-[[(2R)-2-(4-methylpentoxy)-1-oxopropyl]amino]phenyl]methylammonium IUPAC Name: [3-[[(2R)-2-(4-methylpentoxy)propanoyl]amino]phenyl]methylazanium Traditional Name: [3-[[(2R)-2-isohexyloxypropanoyl]amino]benzyl]ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(C)C(=O)NC1=CC=CC(=C1)C[NH3+]

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C[NH3+])OCCCC(C)C

InChI

InChI=1S/C16H26N2O2/c1-12(2)6-5-9-20-13(3)16(19)18-15-8-4-7-14(10-15)11-17/h4,7-8,10,12-13H,5-6,9,11,17H2,1-3H3,(H,18,19)/p+1/t13-/m1/s1