N-[4-[[2,4-bis(fluoranyl)phenyl]methylcarbamoyl]piperidin-4-yl]-7-nitro-1H-indole-2-carboxamide

Systemtic Name: N-[4-[[2,4-bis(fluoranyl)phenyl]methylcarbamoyl]piperidin-4-yl]-7-nitro-1H-indole-2-carboxamide Openeye Name: N-[4-[(2,4-difluorophenyl)methylcarbamoyl]-4-piperidyl]-7-nitro-1H-indole-2-carboxamide CAS Name: N-[4-[[(2,4-difluorophenyl)methylamino]-oxomethyl]-4-piperidinyl]-7-nitro-1H-indole-2-carboxamide IUPAC Name: N-[4-[(2,4-difluorophenyl)methylcarbamoyl]piperidin-4-yl]-7-nitro-1H-indole-2-carboxamide Traditional Name: N-[4-[(2,4-difluorobenzyl)carbamoyl]-4-piperidyl]-7-nitro-1H-indole-2-carboxamide Formula: C22H21F2N5O4 MolecularWeight: 457.430046

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(=O)NCC2=C(C=C(C=C2)F)F)NC(=O)C3=CC4=C(N3)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CNCCC1(C(=O)NCC2=C(C=C(C=C2)F)F)NC(=O)C3=CC4=C(N3)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21F2N5O4/c23-15-5-4-14(16(24)11-15)12-26-21(31)22(6-8-25-9-7-22)28-20(30)17-10-13-2-1-3-18(29(32)33)19(13)27-17/h1-5,10-11,25,27H,6-9,12H2,(H,26,31)(H,28,30)