1-[5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-yl]-2,3-dihydroindole

Systemtic Name: 1-[5-nitro-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidin-4-yl]-2,3-dihydroindole Openeye Name: 1-[6-(4-benzyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]indoline CAS Name: 1-[5-nitro-6-[4-(phenylmethyl)-1-piperidinyl]-4-pyrimidinyl]-2,3-dihydroindole IUPAC Name: 1-[6-(4-benzylpiperidin-1-yl)-5-nitropyrimidin-4-yl]-2,3-dihydroindole Traditional Name: 1-[6-(4-benzylpiperidino)-5-nitro-pyrimidin-4-yl]indoline Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])N4CCC5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])N4CCC5=CC=CC=C54

InChI

InChI=1S/C24H25N5O2/c30-29(31)22-23(27-13-10-19(11-14-27)16-18-6-2-1-3-7-18)25-17-26-24(22)28-15-12-20-8-4-5-9-21(20)28/h1-9,17,19H,10-16H2