[(1S)-1-(4-dimethylaminophenyl)-2-[(3,5-dimethylphenyl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(3,5-dimethylphenyl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(3,5-dimethylbenzoyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-dimethylaminophenyl)-2-[[(3,5-dimethylphenyl)-oxomethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(3,5-dimethylbenzoyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(3,5-dimethylbenzoyl)amino]ethyl]-dimethyl-ammonium Formula: C21H30N3O+ MolecularWeight: 340.4824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC(C2=CC=C(C=C2)N(C)C)[NH+](C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC[C@H](C2=CC=C(C=C2)N(C)C)[NH+](C)C)C

InChI

InChI=1S/C21H29N3O/c1-15-11-16(2)13-18(12-15)21(25)22-14-20(24(5)6)17-7-9-19(10-8-17)23(3)4/h7-13,20H,14H2,1-6H3,(H,22,25)/p+1/t20-/m1/s1