[(2S)-3-methyl-1-[3-[methyl(phenyl)amino]propylamino]-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-3-methyl-1-[3-[methyl(phenyl)amino]propylamino]-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-2-methyl-1-[3-(N-methylanilino)propylcarbamoyl]propyl]ammonium CAS Name: [(2S)-3-methyl-1-[3-(N-methylanilino)propylamino]-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-3-methyl-1-[3-(N-methylanilino)propylamino]-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-2-methyl-1-[3-(N-methylanilino)propylcarbamoyl]propyl]ammonium Formula: C15H26N3O+ MolecularWeight: 264.38644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCCN(C)C1=CC=CC=C1)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O/c1-12(2)14(16)15(19)17-10-7-11-18(3)13-8-5-4-6-9-13/h4-6,8-9,12,14H,7,10-11,16H2,1-3H3,(H,17,19)/p+1/t14-/m0/s1