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

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-[2-(ethoxycarbonylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[2-(ethoxycarbonylamino)-2-oxoethyl]-methylammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[2-(ethoxycarbonylamino)-2-oxoethyl]-methylazanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-[2-(carbethoxyamino)-2-keto-ethyl]-methyl-ammonium Formula: C15H21BrN3O4+ MolecularWeight: 387.24894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)C[NH+](C)CC(=O)NC1=C(C=C(C=C1)Br)C

Isomeric SMILES

CCOC(=O)NC(=O)C[NH+](C)CC(=O)NC1=C(C=C(C=C1)Br)C

InChI

InChI=1S/C15H20BrN3O4/c1-4-23-15(22)18-14(21)9-19(3)8-13(20)17-12-6-5-11(16)7-10(12)2/h5-7H,4,8-9H2,1-3H3,(H,17,20)(H,18,21,22)/p+1