[(1S)-2-[(1-ethylbenzotriazol-5-yl)carbonylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(1-ethylbenzotriazol-5-yl)carbonylamino]-1-(2-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(1-ethylbenzotriazole-5-carbonyl)amino]-1-(2-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(1-ethyl-5-benzotriazolyl)-oxomethyl]amino]-1-(2-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(1-ethylbenzotriazole-5-carbonyl)amino]-1-(2-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(1-ethylbenzotriazole-5-carbonyl)amino]-1-(2-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C20H26N5O2+ MolecularWeight: 368.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NCC(C3=CC=CC=C3OC)[NH+](C)C)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC[C@H](C3=CC=CC=C3OC)[NH+](C)C)N=N1

InChI

InChI=1S/C20H25N5O2/c1-5-25-17-11-10-14(12-16(17)22-23-25)20(26)21-13-18(24(2)3)15-8-6-7-9-19(15)27-4/h6-12,18H,5,13H2,1-4H3,(H,21,26)/p+1/t18-/m1/s1