[(2S)-2-(4-dimethylaminophenyl)-2-(ethoxycarbonylamino)ethyl]azanium

Systemtic Name: [(2S)-2-(4-dimethylaminophenyl)-2-(ethoxycarbonylamino)ethyl]azanium Openeye Name: [(2S)-2-(4-dimethylaminophenyl)-2-(ethoxycarbonylamino)ethyl]ammonium CAS Name: [(2S)-2-(4-dimethylaminophenyl)-2-(ethoxycarbonylamino)ethyl]ammonium IUPAC Name: [(2S)-2-(4-dimethylaminophenyl)-2-(ethoxycarbonylamino)ethyl]azanium Traditional Name: [(2S)-2-(carbethoxyamino)-2-(4-dimethylaminophenyl)ethyl]ammonium Formula: C13H22N3O2+ MolecularWeight: 252.33268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C[NH3+])C1=CC=C(C=C1)N(C)C

Isomeric SMILES

CCOC(=O)N[C@H](C[NH3+])C1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C13H21N3O2/c1-4-18-13(17)15-12(9-14)10-5-7-11(8-6-10)16(2)3/h5-8,12H,4,9,14H2,1-3H3,(H,15,17)/p+1/t12-/m1/s1