[2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylethanoate

Systemtic Name: [2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylethanoate Openeye Name: [2-(3-bromo-4-methyl-anilino)-2-oxo-ethyl] 2-(1-naphthyl)acetate CAS Name: 2-(1-naphthalenyl)acetic acid [2-(3-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methylanilino)-2-oxoethyl] 2-naphthalen-1-ylacetate Traditional Name: 2-(1-naphthyl)acetic acid [2-(3-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C21H18BrNO3 MolecularWeight: 412.27652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CC2=CC=CC3=CC=CC=C32)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CC2=CC=CC3=CC=CC=C32)Br

InChI

InChI=1S/C21H18BrNO3/c1-14-9-10-17(12-19(14)22)23-20(24)13-26-21(25)11-16-7-4-6-15-5-2-3-8-18(15)16/h2-10,12H,11,13H2,1H3,(H,23,24)