2-[3-(imidazol-1-ylmethyl)-1H-indol-2-yl]prop-2-enoic acid

Systemtic Name: 2-[3-(imidazol-1-ylmethyl)-1H-indol-2-yl]prop-2-enoic acid Openeye Name: 2-[3-(imidazol-1-ylmethyl)-1H-indol-2-yl]prop-2-enoic acid CAS Name: 2-[3-(1-imidazolylmethyl)-1H-indol-2-yl]-2-propenoic acid IUPAC Name: 2-[3-(imidazol-1-ylmethyl)-1H-indol-2-yl]prop-2-enoic acid Traditional Name: 2-[3-(imidazol-1-ylmethyl)-1H-indol-2-yl]acrylic acid Formula: C15H13N3O2 MolecularWeight: 267.28262

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C(C2=CC=CC=C2N1)CN3C=CN=C3)C(=O)O

Isomeric SMILES

C=C(C1=C(C2=CC=CC=C2N1)CN3C=CN=C3)C(=O)O

InChI

InChI=1S/C15H13N3O2/c1-10(15(19)20)14-12(8-18-7-6-16-9-18)11-4-2-3-5-13(11)17-14/h2-7,9,17H,1,8H2,(H,19,20)