[(1S)-2-[(4-butoxyphenyl)carbonylamino]-1-(3,4-dimethoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4-butoxyphenyl)carbonylamino]-1-(3,4-dimethoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4-butoxybenzoyl)amino]-1-(3,4-dimethoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4-butoxyphenyl)-oxomethyl]amino]-1-(3,4-dimethoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4-butoxybenzoyl)amino]-1-(3,4-dimethoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4-butoxybenzoyl)amino]-1-(3,4-dimethoxyphenyl)ethyl]-dimethyl-ammonium Formula: C23H33N2O4+ MolecularWeight: 401.51912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(C2=CC(=C(C=C2)OC)OC)[NH+](C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC[C@H](C2=CC(=C(C=C2)OC)OC)[NH+](C)C

InChI

InChI=1S/C23H32N2O4/c1-6-7-14-29-19-11-8-17(9-12-19)23(26)24-16-20(25(2)3)18-10-13-21(27-4)22(15-18)28-5/h8-13,15,20H,6-7,14,16H2,1-5H3,(H,24,26)/p+1/t20-/m1/s1