(2S,3R)-3-methyl-2-pyrrol-1-yl-pent-4-enoic acid

Systemtic Name: (2S,3R)-3-methyl-2-pyrrol-1-yl-pent-4-enoic acid Openeye Name: (2S,3R)-3-methyl-2-pyrrol-1-yl-pent-4-enoic acid CAS Name: (2S,3R)-3-methyl-2-(1-pyrrolyl)-4-pentenoic acid IUPAC Name: (2S,3R)-3-methyl-2-pyrrol-1-ylpent-4-enoic acid Traditional Name: (2S,3R)-3-methyl-2-pyrrol-1-yl-pent-4-enoic acid Formula: C10H13NO2 MolecularWeight: 179.21572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C)C(C(=O)O)N1C=CC=C1

Isomeric SMILES

C[C@H](C=C)[C@@H](C(=O)O)N1C=CC=C1

InChI

InChI=1S/C10H13NO2/c1-3-8(2)9(10(12)13)11-6-4-5-7-11/h3-9H,1H2,2H3,(H,12,13)/t8-,9+/m1/s1