dimethyl-[(1S)-2-[3-[(3S)-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]propanoylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[3-[(3S)-2-oxidanylidene-3,4-dihydro-1H-quinolin-3-yl]propanoylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanoylamino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[1-oxo-3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[3-[(3S)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanoylamino]-1-phenylethyl]azanium Traditional Name: [(1S)-2-[3-[(3S)-2-keto-3,4-dihydro-1H-quinolin-3-yl]propanoylamino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CCC1CC2=CC=CC=C2NC1=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)CC[C@H]1CC2=CC=CC=C2NC1=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-25(2)20(16-8-4-3-5-9-16)15-23-21(26)13-12-18-14-17-10-6-7-11-19(17)24-22(18)27/h3-11,18,20H,12-15H2,1-2H3,(H,23,26)(H,24,27)/p+1/t18-,20+/m0/s1