3-chloranyl-N'-[6-[(3-methoxyphenyl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: 3-chloranyl-N'-[6-[(3-methoxyphenyl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 3-chloro-N'-[6-(3-methoxyanilino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 3-chloro-N'-[6-(3-methoxyanilino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 3-chloro-N'-[6-(3-methoxyanilino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 3-chloro-N'-[6-(m-anisidino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C18H15ClN6O4 MolecularWeight: 414.8025

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN6O4/c1-29-14-7-3-6-13(9-14)22-16-15(25(27)28)17(21-10-20-16)23-24-18(26)11-4-2-5-12(19)8-11/h2-10H,1H3,(H,24,26)(H2,20,21,22,23)