methyl 2-[4-[[5-bromanyl-6-(cyclopropylcarbonylamino)-4-methyl-3-nitro-pyridin-2-yl]methyl]phenyl]benzoate

Systemtic Name: methyl 2-[4-[[5-bromanyl-6-(cyclopropylcarbonylamino)-4-methyl-3-nitro-pyridin-2-yl]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[5-bromo-6-(cyclopropanecarbonylamino)-4-methyl-3-nitro-2-pyridyl]methyl]phenyl]benzoate CAS Name: 2-[4-[[5-bromo-6-[[cyclopropyl(oxo)methyl]amino]-4-methyl-3-nitro-2-pyridinyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[5-bromo-6-(cyclopropanecarbonylamino)-4-methyl-3-nitropyridin-2-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[5-bromo-6-(cyclopropanecarbonylamino)-4-methyl-3-nitro-2-pyridyl]methyl]phenyl]benzoic acid methyl ester Formula: C25H22BrN3O5 MolecularWeight: 524.36328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1Br)NC(=O)C2CC2)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=C1Br)NC(=O)C2CC2)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H22BrN3O5/c1-14-21(26)23(28-24(30)17-11-12-17)27-20(22(14)29(32)33)13-15-7-9-16(10-8-15)18-5-3-4-6-19(18)25(31)34-2/h3-10,17H,11-13H2,1-2H3,(H,27,28,30)