6-chloranyl-8-[(cyclopentylazaniumyl)methyl]-3,4-dimethyl-2-oxidanylidene-chromen-7-olate

Systemtic Name: 6-chloranyl-8-[(cyclopentylazaniumyl)methyl]-3,4-dimethyl-2-oxidanylidene-chromen-7-olate Openeye Name: 6-chloro-8-[(cyclopentylammonio)methyl]-3,4-dimethyl-2-oxo-chromen-7-olate CAS Name: 6-chloro-8-[(cyclopentylammonio)methyl]-3,4-dimethyl-2-oxo-1-benzopyran-7-olate IUPAC Name: 6-chloro-8-[(cyclopentylazaniumyl)methyl]-3,4-dimethyl-2-oxochromen-7-olate Traditional Name: 6-chloro-8-[(cyclopentylammonio)methyl]-2-keto-3,4-dimethyl-chromen-7-olate Formula: C17H20ClNO3 MolecularWeight: 321.7986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH2+]C3CCCC3)C

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)[O-])C[NH2+]C3CCCC3)C

InChI

InChI=1S/C17H20ClNO3/c1-9-10(2)17(21)22-16-12(9)7-14(18)15(20)13(16)8-19-11-5-3-4-6-11/h7,11,19-20H,3-6,8H2,1-2H3