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

Systemtic Name: [2-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl] pentanoate Openeye Name: [2-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]amino]-2-oxo-ethyl] pentanoate CAS Name: pentanoic acid [2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]amino]-2-oxoethyl] pentanoate Traditional Name: valeric acid [2-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]amino]-2-keto-ethyl] ester Formula: C16H21BrN2O4 MolecularWeight: 385.25294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC(=O)NCC(=O)NC1=C(C=C(C=C1)Br)C

Isomeric SMILES

CCCCC(=O)OCC(=O)NCC(=O)NC1=C(C=C(C=C1)Br)C

InChI

InChI=1S/C16H21BrN2O4/c1-3-4-5-16(22)23-10-15(21)18-9-14(20)19-13-7-6-12(17)8-11(13)2/h6-8H,3-5,9-10H2,1-2H3,(H,18,21)(H,19,20)