2-[2-azanyl-3-(4-bromophenyl)carbonyl-5-methyl-phenyl]ethanoic acid

Systemtic Name: 2-[2-azanyl-3-(4-bromophenyl)carbonyl-5-methyl-phenyl]ethanoic acid Openeye Name: 2-[2-amino-3-(4-bromobenzoyl)-5-methyl-phenyl]acetic acid CAS Name: 2-[2-amino-3-[(4-bromophenyl)-oxomethyl]-5-methylphenyl]acetic acid IUPAC Name: 2-[2-amino-3-(4-bromobenzoyl)-5-methylphenyl]acetic acid Traditional Name: 2-[2-amino-3-(4-bromobenzoyl)-5-methyl-phenyl]acetic acid Formula: C16H14BrNO3 MolecularWeight: 348.19126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)N)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)N)CC(=O)O

InChI

InChI=1S/C16H14BrNO3/c1-9-6-11(8-14(19)20)15(18)13(7-9)16(21)10-2-4-12(17)5-3-10/h2-7H,8,18H2,1H3,(H,19,20)