5-[5-[(2S)-2-azanyl-3-(1H-indol-3-yl)propoxy]pyridin-3-yl]isoindol-1-one

Systemtic Name: 5-[5-[(2S)-2-azanyl-3-(1H-indol-3-yl)propoxy]pyridin-3-yl]isoindol-1-one Openeye Name: 5-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridyl]isoindol-1-one CAS Name: 5-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridinyl]-1-isoindolone IUPAC Name: 5-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]pyridin-3-yl]isoindol-1-one Traditional Name: 5-[5-[(2S)-2-amino-3-(1H-indol-3-yl)propoxy]-3-pyridyl]isoindol-1-one Formula: C24H20N4O2 MolecularWeight: 396.4412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(COC3=CN=CC(=C3)C4=CC5=C(C=C4)C(=O)N=C5)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](COC3=CN=CC(=C3)C4=CC5=C(C=C4)C(=O)N=C5)N

InChI

InChI=1S/C24H20N4O2/c25-19(8-18-11-27-23-4-2-1-3-21(18)23)14-30-20-9-16(10-26-13-20)15-5-6-22-17(7-15)12-28-24(22)29/h1-7,9-13,19,27H,8,14,25H2/t19-/m0/s1