[(3S)-3-(benzotriazol-1-yl)-3-[ethanoyl(methyl)amino]propyl]-diethyl-azanium

Systemtic Name: [(3S)-3-(benzotriazol-1-yl)-3-[ethanoyl(methyl)amino]propyl]-diethyl-azanium Openeye Name: [(3S)-3-[acetyl(methyl)amino]-3-(benzotriazol-1-yl)propyl]-diethyl-ammonium CAS Name: [(3S)-3-[acetyl(methyl)amino]-3-(1-benzotriazolyl)propyl]-diethylammonium IUPAC Name: [(3S)-3-[acetyl(methyl)amino]-3-(benzotriazol-1-yl)propyl]-diethylazanium Traditional Name: [(3S)-3-[acetyl(methyl)amino]-3-(benzotriazol-1-yl)propyl]-diethyl-ammonium Formula: C16H26N5O+ MolecularWeight: 304.41054

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC(N1C2=CC=CC=C2N=N1)N(C)C(=O)C

Isomeric SMILES

CC[NH+](CC)CC[C@H](N1C2=CC=CC=C2N=N1)N(C)C(=O)C

InChI

InChI=1S/C16H25N5O/c1-5-20(6-2)12-11-16(19(4)13(3)22)21-15-10-8-7-9-14(15)17-18-21/h7-10,16H,5-6,11-12H2,1-4H3/p+1/t16-/m0/s1