5-methyl-1-(2-oxidanylidenepropyl)-3-pyrrol-1-yl-indole-2-carboxylic acid

Systemtic Name: 5-methyl-1-(2-oxidanylidenepropyl)-3-pyrrol-1-yl-indole-2-carboxylic acid Openeye Name: 1-acetonyl-5-methyl-3-pyrrol-1-yl-indole-2-carboxylic acid CAS Name: 5-methyl-1-(2-oxopropyl)-3-(1-pyrrolyl)-2-indolecarboxylic acid IUPAC Name: 5-methyl-1-(2-oxopropyl)-3-pyrrol-1-ylindole-2-carboxylic acid Traditional Name: 1-acetonyl-5-methyl-3-pyrrol-1-yl-indole-2-carboxylic acid Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2N3C=CC=C3)C(=O)O)CC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2N3C=CC=C3)C(=O)O)CC(=O)C

InChI

InChI=1S/C17H16N2O3/c1-11-5-6-14-13(9-11)15(18-7-3-4-8-18)16(17(21)22)19(14)10-12(2)20/h3-9H,10H2,1-2H3,(H,21,22)