2-[6-chloranyl-1-ethoxycarbonyl-2-(1-methylimidazol-2-yl)carbonyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-1-ethoxycarbonyl-2-(1-methylimidazol-2-yl)carbonyl-indol-3-yl]ethanoic acid Openeye Name: 2-[6-chloro-1-ethoxycarbonyl-2-(1-methylimidazole-2-carbonyl)indol-3-yl]acetic acid CAS Name: 2-[6-chloro-1-ethoxycarbonyl-2-[(1-methyl-2-imidazolyl)-oxomethyl]-3-indolyl]acetic acid IUPAC Name: 2-[6-chloro-1-ethoxycarbonyl-2-(1-methylimidazole-2-carbonyl)indol-3-yl]acetic acid Traditional Name: 2-[1-carbethoxy-6-chloro-2-(1-methylimidazole-2-carbonyl)indol-3-yl]acetic acid Formula: C18H16ClN3O5 MolecularWeight: 389.78974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C(=O)C3=NC=CN3C)CC(=O)O

Isomeric SMILES

CCOC(=O)N1C2=C(C=CC(=C2)Cl)C(=C1C(=O)C3=NC=CN3C)CC(=O)O

InChI

InChI=1S/C18H16ClN3O5/c1-3-27-18(26)22-13-8-10(19)4-5-11(13)12(9-14(23)24)15(22)16(25)17-20-6-7-21(17)2/h4-8H,3,9H2,1-2H3,(H,23,24)