N-[3-(2,3-dihydroindol-1-yl)propyl]-3,4,5-trimethoxy-2-nitro-benzamide

Systemtic Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: N-(3-indolin-1-ylpropyl)-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: N-(3-indolin-1-ylpropyl)-3,4,5-trimethoxy-2-nitro-benzamide Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NCCCN2CCC3=CC=CC=C32)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NCCCN2CCC3=CC=CC=C32)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H25N3O6/c1-28-17-13-15(18(24(26)27)20(30-3)19(17)29-2)21(25)22-10-6-11-23-12-9-14-7-4-5-8-16(14)23/h4-5,7-8,13H,6,9-12H2,1-3H3,(H,22,25)