N-[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]-5-nitro-2-piperidino-benzamide Formula: C30H33N5O3 MolecularWeight: 511.61472

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)C4=CNC5=CC=CC=C54

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C30H33N5O3/c1-33(2)22-12-10-21(11-13-22)26(27-20-31-28-9-5-4-8-24(27)28)19-32-30(36)25-18-23(35(37)38)14-15-29(25)34-16-6-3-7-17-34/h4-5,8-15,18,20,26,31H,3,6-7,16-17,19H2,1-2H3,(H,32,36)