[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-[2-(cyclopropylcarbamoylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[2-[[(cyclopropylamino)-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[2-(cyclopropylcarbamoylamino)-2-oxoethyl]-methylazanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-[2-(cyclopropylcarbamoylamino)-2-keto-ethyl]-methyl-ammonium Formula: C16H22BrN4O3+ MolecularWeight: 398.27488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC(=O)NC(=O)NC2CC2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC(=O)NC(=O)NC2CC2

InChI

InChI=1S/C16H21BrN4O3/c1-10-7-11(17)3-6-13(10)19-14(22)8-21(2)9-15(23)20-16(24)18-12-4-5-12/h3,6-7,12H,4-5,8-9H2,1-2H3,(H,19,22)(H2,18,20,23,24)/p+1