4-[(5-methyl-1H-indol-2-yl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5-methyl-1H-indol-2-yl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(5-methyl-1H-indol-2-yl)methylamino]-4-oxo-butanoic acid CAS Name: 4-[(5-methyl-1H-indol-2-yl)methylamino]-4-oxobutanoic acid IUPAC Name: 4-[(5-methyl-1H-indol-2-yl)methylamino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[(5-methyl-1H-indol-2-yl)methylamino]butyric acid Formula: C14H16N2O3 MolecularWeight: 260.28844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2)CNC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2)CNC(=O)CCC(=O)O

InChI

InChI=1S/C14H16N2O3/c1-9-2-3-12-10(6-9)7-11(16-12)8-15-13(17)4-5-14(18)19/h2-3,6-7,16H,4-5,8H2,1H3,(H,15,17)(H,18,19)