5-bromanyl-1-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]indole-3-carbonitrile

Systemtic Name: 5-bromanyl-1-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl]indole-3-carbonitrile Openeye Name: 5-bromo-1-[2-[(2S)-2-methylindolin-1-yl]-2-oxo-ethyl]indole-3-carbonitrile CAS Name: 5-bromo-1-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-3-indolecarbonitrile IUPAC Name: 5-bromo-1-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]indole-3-carbonitrile Traditional Name: 5-bromo-1-[2-keto-2-[(2S)-2-methylindolin-1-yl]ethyl]indole-3-carbonitrile Formula: C20H16BrN3O MolecularWeight: 394.26454

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CN3C=C(C4=C3C=CC(=C4)Br)C#N

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)CN3C=C(C4=C3C=CC(=C4)Br)C#N

InChI

InChI=1S/C20H16BrN3O/c1-13-8-14-4-2-3-5-18(14)24(13)20(25)12-23-11-15(10-22)17-9-16(21)6-7-19(17)23/h2-7,9,11,13H,8,12H2,1H3/t13-/m0/s1