3-(diethylamino)propyl 2-oxidanylidene-8-prop-2-enyl-chromene-3-carboxylate chloride

Systemtic Name: 3-(diethylamino)propyl 2-oxidanylidene-8-prop-2-enyl-chromene-3-carboxylate chloride Openeye Name: 3-(diethylamino)propyl 8-allyl-2-oxo-chromene-3-carboxylate chloride CAS Name: 2-oxo-8-prop-2-enyl-1-benzopyran-3-carboxylic acid 3-(diethylamino)propyl ester chloride IUPAC Name: 3-(diethylamino)propyl 2-oxo-8-prop-2-enylchromene-3-carboxylate chloride Traditional Name: 8-allyl-2-keto-chromene-3-carboxylic acid 3-(diethylamino)propyl ester chloride Formula: C20H25ClNO4- MolecularWeight: 378.8698

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC(=O)C1=CC2=C(C(=CC=C2)CC=C)OC1=O.[Cl-]

Isomeric SMILES

CCN(CC)CCCOC(=O)C1=CC2=C(C(=CC=C2)CC=C)OC1=O.[Cl-]

InChI

InChI=1S/C20H25NO4.ClH/c1-4-9-15-10-7-11-16-14-17(20(23)25-18(15)16)19(22)24-13-8-12-21(5-2)6-3;/h4,7,10-11,14H,1,5-6,8-9,12-13H2,2-3H3;1H/p-1