3-methyl-1-[(3-methylphenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one hydrate

Systemtic Name: 3-methyl-1-[(3-methylphenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one hydrate Openeye Name: 3-methyl-1-(m-tolylmethoxy)-7,8,9,10-tetrahydrobenzo[c]chromen-6-one hydrate CAS Name: 3-methyl-1-[(3-methylphenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-6-one hydrate IUPAC Name: 3-methyl-1-[(3-methylphenyl)methoxy]-7,8,9,10-tetrahydrobenzo[c]chromen-6-one hydrate Traditional Name: 3-methyl-1-(3-methylbenzyl)oxy-7,8,9,10-tetrahydrobenzo[c]chromen-6-one hydrate Formula: C22H24O4 MolecularWeight: 352.42356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC(=CC3=C2C4=C(CCCC4)C(=O)O3)C.O

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC(=CC3=C2C4=C(CCCC4)C(=O)O3)C.O

InChI

InChI=1S/C22H22O3.H2O/c1-14-6-5-7-16(10-14)13-24-19-11-15(2)12-20-21(19)17-8-3-4-9-18(17)22(23)25-20;/h5-7,10-12H,3-4,8-9,13H2,1-2H3;1H2