[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(2-bromoanilino)-2-oxo-ethyl]-[2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(2-bromoanilino)-2-oxoethyl]-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]-methylammonium IUPAC Name: [2-(2-bromoanilino)-2-oxoethyl]-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]-methylazanium Traditional Name: [2-(2-bromoanilino)-2-keto-ethyl]-[2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl]-methyl-ammonium Formula: C18H25BrN3O2+ MolecularWeight: 395.314

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C[NH+](C)CC(=O)NC1=CC=CC=C1Br

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C[NH+](C)CC(=O)NC1=CC=CC=C1Br

InChI

InChI=1S/C18H24BrN3O2/c1-5-18(6-2,7-3)21-17(24)13-22(4)12-16(23)20-15-11-9-8-10-14(15)19/h1,8-11H,6-7,12-13H2,2-4H3,(H,20,23)(H,21,24)/p+1