methyl 4-[[6-chloranyl-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[6-chloranyl-4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxymethyl]benzoate Openeye Name: methyl 4-[(3-benzyl-6-chloro-4-methyl-2-oxo-chromen-7-yl)oxymethyl]benzoate CAS Name: 4-[[6-chloro-4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-benzyl-6-chloro-4-methyl-2-oxochromen-7-yl)oxymethyl]benzoate Traditional Name: 4-[(3-benzyl-6-chloro-2-keto-4-methyl-chromen-7-yl)oxymethyl]benzoic acid methyl ester Formula: C26H21ClO5 MolecularWeight: 448.89494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)C(=O)OC)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC3=CC=C(C=C3)C(=O)OC)CC4=CC=CC=C4

InChI

InChI=1S/C26H21ClO5/c1-16-20-13-22(27)24(31-15-18-8-10-19(11-9-18)25(28)30-2)14-23(20)32-26(29)21(16)12-17-6-4-3-5-7-17/h3-11,13-14H,12,15H2,1-2H3