4-[[6-[(2S)-2-methyl-2,3-dihydroindol-1-yl]pyridin-3-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[6-[(2S)-2-methyl-2,3-dihydroindol-1-yl]pyridin-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[6-[(2S)-2-methylindolin-1-yl]-3-pyridyl]amino]-4-oxo-butanoate CAS Name: 4-[[6-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-3-pyridinyl]amino]-4-oxobutanoate IUPAC Name: 4-[[6-[(2S)-2-methyl-2,3-dihydroindol-1-yl]pyridin-3-yl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[6-[(2S)-2-methylindolin-1-yl]-3-pyridyl]amino]butyrate Formula: C18H18N3O3- MolecularWeight: 324.35382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC=C(C=C3)NC(=O)CCC(=O)[O-]

Isomeric SMILES

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

InChI

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