2-[6-(2-methylpropanoylamino)-1H-indol-3-yl]-2-pyrrolidin-1-yl-ethanoic acid

Systemtic Name: 2-[6-(2-methylpropanoylamino)-1H-indol-3-yl]-2-pyrrolidin-1-yl-ethanoic acid Openeye Name: 2-[6-(2-methylpropanoylamino)-1H-indol-3-yl]-2-pyrrolidin-1-yl-acetic acid CAS Name: 2-[6-[(2-methyl-1-oxopropyl)amino]-1H-indol-3-yl]-2-(1-pyrrolidinyl)acetic acid IUPAC Name: 2-[6-(2-methylpropanoylamino)-1H-indol-3-yl]-2-pyrrolidin-1-ylacetic acid Traditional Name: 2-[6-(isobutyrylamino)-1H-indol-3-yl]-2-pyrrolidino-acetic acid Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC2=C(C=C1)C(=CN2)C(C(=O)O)N3CCCC3

Isomeric SMILES

CC(C)C(=O)NC1=CC2=C(C=C1)C(=CN2)C(C(=O)O)N3CCCC3

InChI

InChI=1S/C18H23N3O3/c1-11(2)17(22)20-12-5-6-13-14(10-19-15(13)9-12)16(18(23)24)21-7-3-4-8-21/h5-6,9-11,16,19H,3-4,7-8H2,1-2H3,(H,20,22)(H,23,24)