butyl 5-butoxy-3,4-dimethyl-2-oxidanylidene-chromene-6-carboxylate; methanamine

Systemtic Name: butyl 5-butoxy-3,4-dimethyl-2-oxidanylidene-chromene-6-carboxylate; methanamine Openeye Name: butyl 5-butoxy-3,4-dimethyl-2-oxo-chromene-6-carboxylate; methanamine CAS Name: 5-butoxy-3,4-dimethyl-2-oxo-1-benzopyran-6-carboxylic acid butyl ester; methanamine IUPAC Name: butyl 5-butoxy-3,4-dimethyl-2-oxochromene-6-carboxylate; methanamine Traditional Name: 5-butoxy-2-keto-3,4-dimethyl-chromene-6-carboxylic acid butyl ester; methylamine Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC2=C1C(=C(C(=O)O2)C)C)C(=O)OCCCC.CN

Isomeric SMILES

CCCCOC1=C(C=CC2=C1C(=C(C(=O)O2)C)C)C(=O)OCCCC.CN

InChI

InChI=1S/C20H26O5.CH5N/c1-5-7-11-23-18-15(20(22)24-12-8-6-2)9-10-16-17(18)13(3)14(4)19(21)25-16;1-2/h9-10H,5-8,11-12H2,1-4H3;2H2,1H3