3-chloranyl-4,8-dimethyl-7-propoxy-chromen-2-one; methanamine; hydrochloride

Systemtic Name: 3-chloranyl-4,8-dimethyl-7-propoxy-chromen-2-one; methanamine; hydrochloride Openeye Name: 3-chloro-4,8-dimethyl-7-propoxy-chromen-2-one; methanamine; hydrochloride CAS Name: 3-chloro-4,8-dimethyl-7-propoxy-1-benzopyran-2-one; methanamine; hydrochloride IUPAC Name: 3-chloro-4,8-dimethyl-7-propoxychromen-2-one; methanamine; hydrochloride Traditional Name: 3-chloro-4,8-dimethyl-7-propoxy-coumarin; methylamine; hydrochloride Formula: C15H21Cl2NO3 MolecularWeight: 334.23814

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=C(C=C1)C(=C(C(=O)O2)Cl)C)C.CN.Cl

Isomeric SMILES

CCCOC1=C(C2=C(C=C1)C(=C(C(=O)O2)Cl)C)C.CN.Cl

InChI

InChI=1S/C14H15ClO3.CH5N.ClH/c1-4-7-17-11-6-5-10-8(2)12(15)14(16)18-13(10)9(11)3;1-2;/h5-6H,4,7H2,1-3H3;2H2,1H3;1H