6-chloranyl-8-[(cyclohexylazaniumyl)methyl]-3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-2-oxidanylidene-chromen-7-olate

Systemtic Name: 6-chloranyl-8-[(cyclohexylazaniumyl)methyl]-3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-2-oxidanylidene-chromen-7-olate Openeye Name: 6-chloro-8-[(cyclohexylammonio)methyl]-3-(2-methoxy-2-oxo-ethyl)-4-methyl-2-oxo-chromen-7-olate CAS Name: 6-chloro-8-[(cyclohexylammonio)methyl]-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-1-benzopyran-7-olate IUPAC Name: 6-chloro-8-[(cyclohexylazaniumyl)methyl]-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxochromen-7-olate Traditional Name: 6-chloro-8-[(cyclohexylammonio)methyl]-2-keto-3-(2-keto-2-methoxy-ethyl)-4-methyl-chromen-7-olate Formula: C20H24ClNO5 MolecularWeight: 393.86126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH2+]C3CCCCC3)CC(=O)OC

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH2+]C3CCCCC3)CC(=O)OC

InChI

InChI=1S/C20H24ClNO5/c1-11-13-8-16(21)18(24)15(10-22-12-6-4-3-5-7-12)19(13)27-20(25)14(11)9-17(23)26-2/h8,12,22,24H,3-7,9-10H2,1-2H3