5-methyl-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-4-propan-2-yl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-methyl-3-[(E)-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-4-propan-2-yl-1H-pyrrole-2-carboxylic acid Openeye Name: 3-[(E)-3-anilino-3-oxo-prop-1-enyl]-4-isopropyl-5-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-5-methyl-4-propan-2-yl-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-[(E)-3-anilino-3-oxoprop-1-enyl]-5-methyl-4-propan-2-yl-1H-pyrrole-2-carboxylic acid Traditional Name: 3-[(E)-3-anilino-3-keto-prop-1-enyl]-4-isopropyl-5-methyl-1H-pyrrole-2-carboxylic acid Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C(=O)O)C=CC(=O)NC2=CC=CC=C2)C(C)C

Isomeric SMILES

CC1=C(C(=C(N1)C(=O)O)/C=C/C(=O)NC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C18H20N2O3/c1-11(2)16-12(3)19-17(18(22)23)14(16)9-10-15(21)20-13-7-5-4-6-8-13/h4-11,19H,1-3H3,(H,20,21)(H,22,23)/b10-9+