4-[[3-(1H-indol-3-yl)-3-oxidanylidene-propyl]carbamoyl]hexyl 2-chloranylethanoate

Systemtic Name: 4-[[3-(1H-indol-3-yl)-3-oxidanylidene-propyl]carbamoyl]hexyl 2-chloranylethanoate Openeye Name: 4-[[3-(1H-indol-3-yl)-3-oxo-propyl]carbamoyl]hexyl 2-chloroacetate CAS Name: 2-chloroacetic acid 4-[[[3-(1H-indol-3-yl)-3-oxopropyl]amino]-oxomethyl]hexyl ester IUPAC Name: 4-[[3-(1H-indol-3-yl)-3-oxopropyl]carbamoyl]hexyl 2-chloroacetate Traditional Name: 2-chloroacetic acid 4-[[3-(1H-indol-3-yl)-3-keto-propyl]carbamoyl]hexyl ester Formula: C20H25ClN2O4 MolecularWeight: 392.8765

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCOC(=O)CCl)C(=O)NCCC(=O)C1=CNC2=CC=CC=C21

Isomeric SMILES

CCC(CCCOC(=O)CCl)C(=O)NCCC(=O)C1=CNC2=CC=CC=C21

InChI

InChI=1S/C20H25ClN2O4/c1-2-14(6-5-11-27-19(25)12-21)20(26)22-10-9-18(24)16-13-23-17-8-4-3-7-15(16)17/h3-4,7-8,13-14,23H,2,5-6,9-12H2,1H3,(H,22,26)