[(1S)-1-(4-dimethylaminophenyl)-2-[(2-ethoxyphenyl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(2-ethoxyphenyl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(2-ethoxybenzoyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-dimethylaminophenyl)-2-[[(2-ethoxyphenyl)-oxomethyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(2-ethoxybenzoyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(2-ethoxybenzoyl)amino]ethyl]-dimethyl-ammonium Formula: C21H30N3O2+ MolecularWeight: 356.4818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NCC(C2=CC=C(C=C2)N(C)C)[NH+](C)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC[C@H](C2=CC=C(C=C2)N(C)C)[NH+](C)C

InChI

InChI=1S/C21H29N3O2/c1-6-26-20-10-8-7-9-18(20)21(25)22-15-19(24(4)5)16-11-13-17(14-12-16)23(2)3/h7-14,19H,6,15H2,1-5H3,(H,22,25)/p+1/t19-/m1/s1