(2Z)-2-[(5-methyl-1H-imidazol-4-yl)methylidene]-5-(2-oxidanylidene-1,3-dihydroindol-4-yl)pent-4-ynoic acid

Systemtic Name: (2Z)-2-[(5-methyl-1H-imidazol-4-yl)methylidene]-5-(2-oxidanylidene-1,3-dihydroindol-4-yl)pent-4-ynoic acid Openeye Name: (2Z)-2-[(5-methyl-1H-imidazol-4-yl)methylene]-5-(2-oxoindolin-4-yl)pent-4-ynoic acid CAS Name: (2Z)-2-[(5-methyl-1H-imidazol-4-yl)methylidene]-5-(2-oxo-1,3-dihydroindol-4-yl)-4-pentynoic acid IUPAC Name: (2Z)-2-[(5-methyl-1H-imidazol-4-yl)methylidene]-5-(2-oxo-1,3-dihydroindol-4-yl)pent-4-ynoic acid Traditional Name: (2Z)-5-(2-ketoindolin-4-yl)-2-[(5-methyl-1H-imidazol-4-yl)methylene]pent-4-ynoic acid Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)C=C(CC#CC2=C3CC(=O)NC3=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(N=CN1)/C=C(/CC#CC2=C3CC(=O)NC3=CC=C2)\C(=O)O

InChI

InChI=1S/C18H15N3O3/c1-11-16(20-10-19-11)8-13(18(23)24)6-2-4-12-5-3-7-15-14(12)9-17(22)21-15/h3,5,7-8,10H,6,9H2,1H3,(H,19,20)(H,21,22)(H,23,24)/b13-8-