ethanedioic acid; 2-(3-methylbutylamino)-1-(2-methyl-1H-indol-3-yl)ethanone

Systemtic Name: ethanedioic acid; 2-(3-methylbutylamino)-1-(2-methyl-1H-indol-3-yl)ethanone Openeye Name: 2-(isopentylamino)-1-(2-methyl-1H-indol-3-yl)ethanone; oxalic acid CAS Name: 2-(3-methylbutylamino)-1-(2-methyl-1H-indol-3-yl)ethanone; oxalic acid IUPAC Name: 2-(3-methylbutylamino)-1-(2-methyl-1H-indol-3-yl)ethanone; oxalic acid Traditional Name: 2-(isoamylamino)-1-(2-methyl-1H-indol-3-yl)ethanone; oxalic acid Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CNCCC(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CNCCC(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H22N2O.C2H2O4/c1-11(2)8-9-17-10-15(19)16-12(3)18-14-7-5-4-6-13(14)16;3-1(4)2(5)6/h4-7,11,17-18H,8-10H2,1-3H3;(H,3,4)(H,5,6)