ethyl 3-[(1-propanoyl-2,3-dihydroindol-5-yl)methylcarbamoylamino]benzoate

Systemtic Name: ethyl 3-[(1-propanoyl-2,3-dihydroindol-5-yl)methylcarbamoylamino]benzoate Openeye Name: ethyl 3-[(1-propanoylindolin-5-yl)methylcarbamoylamino]benzoate CAS Name: 3-[[oxo-[[1-(1-oxopropyl)-2,3-dihydroindol-5-yl]methylamino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(1-propanoyl-2,3-dihydroindol-5-yl)methylcarbamoylamino]benzoate Traditional Name: 3-[(1-propionylindolin-5-yl)methylcarbamoylamino]benzoic acid ethyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C1C=CC(=C2)CNC(=O)NC3=CC=CC(=C3)C(=O)OCC

Isomeric SMILES

CCC(=O)N1CCC2=C1C=CC(=C2)CNC(=O)NC3=CC=CC(=C3)C(=O)OCC

InChI

InChI=1S/C22H25N3O4/c1-3-20(26)25-11-10-16-12-15(8-9-19(16)25)14-23-22(28)24-18-7-5-6-17(13-18)21(27)29-4-2/h5-9,12-13H,3-4,10-11,14H2,1-2H3,(H2,23,24,28)