(4-methoxycarbonyl-5-methyl-furan-2-yl)methyl (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: (4-methoxycarbonyl-5-methyl-furan-2-yl)methyl (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: (4-methoxycarbonyl-5-methyl-2-furyl)methyl (3S)-6-chlorochromane-3-carboxylate CAS Name: (3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid (4-methoxycarbonyl-5-methyl-2-furanyl)methyl ester IUPAC Name: (4-methoxycarbonyl-5-methylfuran-2-yl)methyl (3S)-6-chloro-3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: (3S)-6-chlorochroman-3-carboxylic acid (4-carbomethoxy-5-methyl-2-furyl)methyl ester Formula: C18H17ClO6 MolecularWeight: 364.77698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)C2CC3=C(C=CC(=C3)Cl)OC2)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)[C@H]2CC3=C(C=CC(=C3)Cl)OC2)C(=O)OC

InChI

InChI=1S/C18H17ClO6/c1-10-15(18(21)22-2)7-14(25-10)9-24-17(20)12-5-11-6-13(19)3-4-16(11)23-8-12/h3-4,6-7,12H,5,8-9H2,1-2H3/t12-/m0/s1