(E)-4-azanyl-3-[3-(1-oxidanyl-2-pyrrolidin-1-yl-ethyl)-1H-indol-2-yl]hex-3-en-2-one

Systemtic Name: (E)-4-azanyl-3-[3-(1-oxidanyl-2-pyrrolidin-1-yl-ethyl)-1H-indol-2-yl]hex-3-en-2-one Openeye Name: (E)-4-amino-3-[3-(1-hydroxy-2-pyrrolidin-1-yl-ethyl)-1H-indol-2-yl]hex-3-en-2-one CAS Name: (E)-4-amino-3-[3-[1-hydroxy-2-(1-pyrrolidinyl)ethyl]-1H-indol-2-yl]-3-hexen-2-one IUPAC Name: (E)-4-amino-3-[3-(1-hydroxy-2-pyrrolidin-1-ylethyl)-1H-indol-2-yl]hex-3-en-2-one Traditional Name: (E)-4-amino-3-[3-(1-hydroxy-2-pyrrolidino-ethyl)-1H-indol-2-yl]hex-3-en-2-one Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=C(C2=CC=CC=C2N1)C(CN3CCCC3)O)C(=O)C)N

Isomeric SMILES

CC/C(=C(/C1=C(C2=CC=CC=C2N1)C(CN3CCCC3)O)\C(=O)C)/N

InChI

InChI=1S/C20H27N3O2/c1-3-15(21)18(13(2)24)20-19(14-8-4-5-9-16(14)22-20)17(25)12-23-10-6-7-11-23/h4-5,8-9,17,22,25H,3,6-7,10-12,21H2,1-2H3/b18-15-