4-[[5-[(2S)-2-methyl-2,3-dihydroindol-1-yl]pyridin-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-[(2S)-2-methyl-2,3-dihydroindol-1-yl]pyridin-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-[(2S)-2-methylindolin-1-yl]-2-pyridyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[5-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-pyridinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[5-[(2S)-2-methyl-2,3-dihydroindol-1-yl]pyridin-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[5-[(2S)-2-methylindolin-1-yl]-2-pyridyl]amino]butyric acid Formula: C18H19N3O3 MolecularWeight: 325.36176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=CN=C(C=C3)NC(=O)CCC(=O)O

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C3=CN=C(C=C3)NC(=O)CCC(=O)O

InChI

InChI=1S/C18H19N3O3/c1-12-10-13-4-2-3-5-15(13)21(12)14-6-7-16(19-11-14)20-17(22)8-9-18(23)24/h2-7,11-12H,8-10H2,1H3,(H,23,24)(H,19,20,22)/t12-/m0/s1