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

Systemtic Name: [(1S)-2-[(3,4-diethoxyphenyl)carbonylamino]-1-(4-dimethylaminophenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(3,4-diethoxybenzoyl)amino]-1-(4-dimethylaminophenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(3,4-diethoxyphenyl)-oxomethyl]amino]-1-(4-dimethylaminophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(3,4-diethoxybenzoyl)amino]-1-(4-dimethylaminophenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(3,4-diethoxybenzoyl)amino]-1-(4-dimethylaminophenyl)ethyl]-dimethyl-ammonium Formula: C23H34N3O3+ MolecularWeight: 400.53436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(C2=CC=C(C=C2)N(C)C)[NH+](C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC[C@H](C2=CC=C(C=C2)N(C)C)[NH+](C)C)OCC

InChI

InChI=1S/C23H33N3O3/c1-7-28-21-14-11-18(15-22(21)29-8-2)23(27)24-16-20(26(5)6)17-9-12-19(13-10-17)25(3)4/h9-15,20H,7-8,16H2,1-6H3,(H,24,27)/p+1/t20-/m1/s1