2-[5-[(2-bromophenyl)carbonylamino]-3-methyl-pyrazol-1-yl]ethyl 2-bromanylbenzoate

Systemtic Name: 2-[5-[(2-bromophenyl)carbonylamino]-3-methyl-pyrazol-1-yl]ethyl 2-bromanylbenzoate Openeye Name: 2-[5-[(2-bromobenzoyl)amino]-3-methyl-pyrazol-1-yl]ethyl 2-bromobenzoate CAS Name: 2-bromobenzoic acid 2-[5-[[(2-bromophenyl)-oxomethyl]amino]-3-methyl-1-pyrazolyl]ethyl ester IUPAC Name: 2-[5-[(2-bromobenzoyl)amino]-3-methylpyrazol-1-yl]ethyl 2-bromobenzoate Traditional Name: 2-bromobenzoic acid 2-[5-[(2-bromobenzoyl)amino]-3-methyl-pyrazol-1-yl]ethyl ester Formula: C20H17Br2N3O3 MolecularWeight: 507.17528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC=CC=C2Br)CCOC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC=CC=C2Br)CCOC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C20H17Br2N3O3/c1-13-12-18(23-19(26)14-6-2-4-8-16(14)21)25(24-13)10-11-28-20(27)15-7-3-5-9-17(15)22/h2-9,12H,10-11H2,1H3,(H,23,26)