(4S)-8-chloranyl-4-[5-(hydroxymethyl)imidazol-1-yl]-3,3-dimethyl-4H-isochromen-1-one

Systemtic Name: (4S)-8-chloranyl-4-[5-(hydroxymethyl)imidazol-1-yl]-3,3-dimethyl-4H-isochromen-1-one Openeye Name: (4S)-8-chloro-4-[5-(hydroxymethyl)imidazol-1-yl]-3,3-dimethyl-isochroman-1-one CAS Name: (4S)-8-chloro-4-[5-(hydroxymethyl)-1-imidazolyl]-3,3-dimethyl-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (4S)-8-chloro-4-[5-(hydroxymethyl)imidazol-1-yl]-3,3-dimethyl-4H-isochromen-1-one Traditional Name: (4S)-8-chloro-3,3-dimethyl-4-(5-methylolimidazol-1-yl)isochroman-1-one Formula: C15H15ClN2O3 MolecularWeight: 306.7442

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=C(C(=CC=C2)Cl)C(=O)O1)N3C=NC=C3CO)C

Isomeric SMILES

CC1([C@H](C2=C(C(=CC=C2)Cl)C(=O)O1)N3C=NC=C3CO)C

InChI

InChI=1S/C15H15ClN2O3/c1-15(2)13(18-8-17-6-9(18)7-19)10-4-3-5-11(16)12(10)14(20)21-15/h3-6,8,13,19H,7H2,1-2H3/t13-/m0/s1