methyl (E)-3-[4-chloranyl-7-(diethylamino)-2-oxidanylidene-chromen-3-yl]prop-2-enoate

Systemtic Name: methyl (E)-3-[4-chloranyl-7-(diethylamino)-2-oxidanylidene-chromen-3-yl]prop-2-enoate Openeye Name: methyl (E)-3-[4-chloro-7-(diethylamino)-2-oxo-chromen-3-yl]prop-2-enoate CAS Name: (E)-3-[4-chloro-7-(diethylamino)-2-oxo-1-benzopyran-3-yl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-chloro-7-(diethylamino)-2-oxochromen-3-yl]prop-2-enoate Traditional Name: (E)-3-[4-chloro-7-(diethylamino)-2-keto-chromen-3-yl]acrylic acid methyl ester Formula: C17H18ClNO4 MolecularWeight: 335.78212

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)C=CC(=O)OC)Cl

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)/C=C/C(=O)OC)Cl

InChI

InChI=1S/C17H18ClNO4/c1-4-19(5-2)11-6-7-12-14(10-11)23-17(21)13(16(12)18)8-9-15(20)22-3/h6-10H,4-5H2,1-3H3/b9-8+