3-nitro-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]imidazo[1,2-a]pyridine

Systemtic Name: 3-nitro-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]imidazo[1,2-a]pyridine Openeye Name: 2-(4-benzyl-1,4-diazepan-1-yl)-3-nitro-imidazo[1,2-a]pyridine CAS Name: 3-nitro-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]imidazo[1,2-a]pyridine IUPAC Name: 2-(4-benzyl-1,4-diazepan-1-yl)-3-nitroimidazo[1,2-a]pyridine Traditional Name: 2-(4-benzyl-1,4-diazepan-1-yl)-3-nitro-imidazo[1,2-a]pyridine Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=C(N3C=CC=CC3=N2)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C2=C(N3C=CC=CC3=N2)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C19H21N5O2/c25-24(26)19-18(20-17-9-4-5-12-23(17)19)22-11-6-10-21(13-14-22)15-16-7-2-1-3-8-16/h1-5,7-9,12H,6,10-11,13-15H2