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methyl 4-(diethylaminomethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate hydrochloride

methyl 4-(diethylaminomethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate hydrochloride

Systemtic Name:methyl 4-(diethylaminomethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate hydrochloride
Openeye Name:methyl 4-(diethylaminomethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate hydrochloride
CAS Name:4-(diethylaminomethyl)-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylic acid methyl ester hydrochloride
IUPAC Name:methyl 4-(diethylaminomethyl)-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxylate hydrochloride
Traditional Name:4-(diethylaminomethyl)-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylic acid methyl ester hydrochloride
Formula: C23H25ClN4O4
MolecularWeight: 456.922
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC(=NC(=C1C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3.Cl


Isomeric SMILES

CCN(CC)CC1=NC(=NC(=C1C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3.Cl


InChI

InChI=1S/C23H24N4O4.ClH/c1-4-26(5-2)15-19-20(23(28)31-3)21(17-12-9-13-18(14-17)27(29)30)25-22(24-19)16-10-7-6-8-11-16;/h6-14H,4-5,15H2,1-3H3;1H


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