(E)-3-(3-imidazol-1-yl-2-methyl-3,4-dihydro-2H-chromen-6-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-imidazol-1-yl-2-methyl-3,4-dihydro-2H-chromen-6-yl)prop-2-enoic acid Openeye Name: (E)-3-(3-imidazol-1-yl-2-methyl-chroman-6-yl)prop-2-enoic acid CAS Name: (E)-3-[3-(1-imidazolyl)-2-methyl-3,4-dihydro-2H-1-benzopyran-6-yl]-2-propenoic acid IUPAC Name: (E)-3-(3-imidazol-1-yl-2-methyl-3,4-dihydro-2H-chromen-6-yl)prop-2-enoic acid Traditional Name: (E)-3-(3-imidazol-1-yl-2-methyl-chroman-6-yl)acrylic acid Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC2=C(O1)C=CC(=C2)C=CC(=O)O)N3C=CN=C3

Isomeric SMILES

CC1C(CC2=C(O1)C=CC(=C2)/C=C/C(=O)O)N3C=CN=C3

InChI

InChI=1S/C16H16N2O3/c1-11-14(18-7-6-17-10-18)9-13-8-12(3-5-16(19)20)2-4-15(13)21-11/h2-8,10-11,14H,9H2,1H3,(H,19,20)/b5-3+