methyl 6-(3-chloranylpropyl)-4-oxidanylidene-3-propyl-5,7-dihydro-1,2-benzoxazole-6-carboxylate

Systemtic Name: methyl 6-(3-chloranylpropyl)-4-oxidanylidene-3-propyl-5,7-dihydro-1,2-benzoxazole-6-carboxylate Openeye Name: methyl 6-(3-chloropropyl)-4-oxo-3-propyl-5,7-dihydro-1,2-benzoxazole-6-carboxylate CAS Name: 6-(3-chloropropyl)-4-oxo-3-propyl-5,7-dihydro-1,2-benzoxazole-6-carboxylic acid methyl ester IUPAC Name: methyl 6-(3-chloropropyl)-4-oxo-3-propyl-5,7-dihydro-1,2-benzoxazole-6-carboxylate Traditional Name: 6-(3-chloropropyl)-4-keto-3-propyl-5,7-dihydroindoxazene-6-carboxylic acid methyl ester Formula: C15H20ClNO4 MolecularWeight: 313.7766

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NOC2=C1C(=O)CC(C2)(CCCCl)C(=O)OC

Isomeric SMILES

CCCC1=NOC2=C1C(=O)CC(C2)(CCCCl)C(=O)OC

InChI

InChI=1S/C15H20ClNO4/c1-3-5-10-13-11(18)8-15(6-4-7-16,14(19)20-2)9-12(13)21-17-10/h3-9H2,1-2H3