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

Systemtic Name: methyl 2-[4-[[5-(cyclopropylcarbonylamino)-4-methyl-3-nitro-pyridin-2-yl]methyl]phenyl]benzoate Openeye Name: methyl 2-[4-[[5-(cyclopropanecarbonylamino)-4-methyl-3-nitro-2-pyridyl]methyl]phenyl]benzoate CAS Name: 2-[4-[[5-[[cyclopropyl(oxo)methyl]amino]-4-methyl-3-nitro-2-pyridinyl]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[[5-(cyclopropanecarbonylamino)-4-methyl-3-nitropyridin-2-yl]methyl]phenyl]benzoate Traditional Name: 2-[4-[[5-(cyclopropanecarbonylamino)-4-methyl-3-nitro-2-pyridyl]methyl]phenyl]benzoic acid methyl ester Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1NC(=O)C2CC2)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC=C1NC(=O)C2CC2)CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H23N3O5/c1-15-22(27-24(29)18-11-12-18)14-26-21(23(15)28(31)32)13-16-7-9-17(10-8-16)19-5-3-4-6-20(19)25(30)33-2/h3-10,14,18H,11-13H2,1-2H3,(H,27,29)