4-[(4-bromophenyl)amino]-3-butanoyl-6-methyl-pyran-2-one

Systemtic Name: 4-[(4-bromophenyl)amino]-3-butanoyl-6-methyl-pyran-2-one Openeye Name: 4-(4-bromoanilino)-3-butanoyl-6-methyl-pyran-2-one CAS Name: 4-(4-bromoanilino)-6-methyl-3-(1-oxobutyl)-2-pyranone IUPAC Name: 4-(4-bromoanilino)-3-butanoyl-6-methylpyran-2-one Traditional Name: 4-(4-bromoanilino)-3-butyryl-6-methyl-pyran-2-one Formula: C16H16BrNO3 MolecularWeight: 350.20714

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C=C(OC1=O)C)NC2=CC=C(C=C2)Br

Isomeric SMILES

CCCC(=O)C1=C(C=C(OC1=O)C)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H16BrNO3/c1-3-4-14(19)15-13(9-10(2)21-16(15)20)18-12-7-5-11(17)6-8-12/h5-9,18H,3-4H2,1-2H3