6-[[3-(2-azanylethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazin-1-yl]hexan-1-one

Systemtic Name: 6-[[3-(2-azanylethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazin-1-yl]hexan-1-one Openeye Name: 6-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazin-1-yl]hexan-1-one CAS Name: 6-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)-1-piperazinyl]-1-hexanone IUPAC Name: 6-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazin-1-yl]hexan-1-one Traditional Name: 6-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1-[4-(4-nitrophenyl)piperazino]hexan-1-one Formula: C26H33N5O4 MolecularWeight: 479.57132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCCCCOC3=CC4=C(C=C3)NC=C4CCN

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CCCCCOC3=CC4=C(C=C3)NC=C4CCN

InChI

InChI=1S/C26H33N5O4/c27-12-11-20-19-28-25-10-9-23(18-24(20)25)35-17-3-1-2-4-26(32)30-15-13-29(14-16-30)21-5-7-22(8-6-21)31(33)34/h5-10,18-19,28H,1-4,11-17,27H2