[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoate

Systemtic Name: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)ethanoate Openeye Name: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetate CAS Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetate Traditional Name: 2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)acetic acid [2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C21H18ClNO5 MolecularWeight: 399.82432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C21H18ClNO5/c1-12(20(25)15-11-23-17-5-3-2-4-14(15)17)28-19(24)10-13-8-16(22)21-18(9-13)26-6-7-27-21/h2-5,8-9,11-12,23H,6-7,10H2,1H3