2-methyl-5-[2-[3-(2-oxidanylidenepropylamino)pyrrolidin-1-yl]ethoxy]-1H-indole-3-carboxylic acid

Systemtic Name: 2-methyl-5-[2-[3-(2-oxidanylidenepropylamino)pyrrolidin-1-yl]ethoxy]-1H-indole-3-carboxylic acid Openeye Name: 5-[2-[3-(acetonylamino)pyrrolidin-1-yl]ethoxy]-2-methyl-1H-indole-3-carboxylic acid CAS Name: 2-methyl-5-[2-[3-(2-oxopropylamino)-1-pyrrolidinyl]ethoxy]-1H-indole-3-carboxylic acid IUPAC Name: 2-methyl-5-[2-[3-(2-oxopropylamino)pyrrolidin-1-yl]ethoxy]-1H-indole-3-carboxylic acid Traditional Name: 5-[2-[3-(acetonylamino)pyrrolidino]ethoxy]-2-methyl-1H-indole-3-carboxylic acid Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OCCN3CCC(C3)NCC(=O)C)C(=O)O

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OCCN3CCC(C3)NCC(=O)C)C(=O)O

InChI

InChI=1S/C19H25N3O4/c1-12(23)10-20-14-5-6-22(11-14)7-8-26-15-3-4-17-16(9-15)18(19(24)25)13(2)21-17/h3-4,9,14,20-21H,5-8,10-11H2,1-2H3,(H,24,25)