1-[2-[(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azaniumyl]-2-oxidanylidene-ethyl]cyclopentane-1-carboxylate

Systemtic Name: 1-[2-[(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azaniumyl]-2-oxidanylidene-ethyl]cyclopentane-1-carboxylate Openeye Name: 1-[2-[(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)ammonio]-2-oxo-ethyl]cyclopentanecarboxylate CAS Name: 1-[2-[(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)ammonio]-2-oxoethyl]-1-cyclopentanecarboxylate IUPAC Name: 1-[2-[(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azaniumyl]-2-oxoethyl]cyclopentane-1-carboxylate Traditional Name: 1-[2-[(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)ammonio]-2-keto-ethyl]cyclopentanecarboxylate Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(=[NH+]C(=O)CC3(CCCC3)C(=O)[O-])CC2OC(=C1)O

Isomeric SMILES

CC1=C2CCC(=[NH+]C(=O)CC3(CCCC3)C(=O)[O-])CC2OC(=C1)O

InChI

InChI=1S/C18H23NO5/c1-11-8-16(21)24-14-9-12(4-5-13(11)14)19-15(20)10-18(17(22)23)6-2-3-7-18/h8,14,21H,2-7,9-10H2,1H3,(H,22,23)