[(1S)-2-[(2,3-dimethyl-1H-indol-5-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(2,3-dimethyl-1H-indol-5-yl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(2,3-dimethyl-1H-indol-5-yl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C21H26N3O+ MolecularWeight: 336.45064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)NCC(C3=CC=CC=C3)[NH+](C)C)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)NC[C@H](C3=CC=CC=C3)[NH+](C)C)C

InChI

InChI=1S/C21H25N3O/c1-14-15(2)23-19-11-10-17(12-18(14)19)21(25)22-13-20(24(3)4)16-8-6-5-7-9-16/h5-12,20,23H,13H2,1-4H3,(H,22,25)/p+1/t20-/m1/s1