butyl-[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]carbamic acid

Systemtic Name: butyl-[2-[(4-chlorophenyl)amino]-5-nitro-pyrimidin-4-yl]carbamic acid Openeye Name: butyl-[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]carbamic acid CAS Name: butyl-[2-(4-chloroanilino)-5-nitro-4-pyrimidinyl]carbamic acid IUPAC Name: butyl-[2-(4-chloroanilino)-5-nitropyrimidin-4-yl]carbamic acid Traditional Name: butyl-[2-(4-chloroanilino)-5-nitro-pyrimidin-4-yl]carbamic acid Formula: C15H16ClN5O4 MolecularWeight: 365.77164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CCCCN(C1=NC(=NC=C1[N+](=O)[O-])NC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H16ClN5O4/c1-2-3-8-20(15(22)23)13-12(21(24)25)9-17-14(19-13)18-11-6-4-10(16)5-7-11/h4-7,9H,2-3,8H2,1H3,(H,22,23)(H,17,18,19)