7-[[(5S)-3-(4-dimethylaminophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methoxy]-4-methyl-chromen-2-one

Systemtic Name: 7-[[(5S)-3-(4-dimethylaminophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methoxy]-4-methyl-chromen-2-one Openeye Name: 7-[[(5S)-3-(4-dimethylaminophenyl)-2,5-dihydroisoxazol-5-yl]methoxy]-4-methyl-chromen-2-one CAS Name: 7-[[(5S)-3-(4-dimethylaminophenyl)-2,5-dihydroisoxazol-5-yl]methoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[[(5S)-3-(4-dimethylaminophenyl)-2,5-dihydro-1,2-oxazol-5-yl]methoxy]-4-methylchromen-2-one Traditional Name: 7-[[(5S)-3-(4-dimethylaminophenyl)-3-isoxazolin-5-yl]methoxy]-4-methyl-coumarin Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC3C=C(NO3)C4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC[C@@H]3C=C(NO3)C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C22H22N2O4/c1-14-10-22(25)27-21-12-17(8-9-19(14)21)26-13-18-11-20(23-28-18)15-4-6-16(7-5-15)24(2)3/h4-12,18,23H,13H2,1-3H3/t18-/m0/s1