N-[3-[(4-nitrophenyl)amino]propyl]-2-(4-phenylpiperazin-1-yl)ethanamide

Systemtic Name: N-[3-[(4-nitrophenyl)amino]propyl]-2-(4-phenylpiperazin-1-yl)ethanamide Openeye Name: N-[3-(4-nitroanilino)propyl]-2-(4-phenylpiperazin-1-yl)acetamide CAS Name: N-[3-(4-nitroanilino)propyl]-2-(4-phenyl-1-piperazinyl)acetamide IUPAC Name: N-[3-(4-nitroanilino)propyl]-2-(4-phenylpiperazin-1-yl)acetamide Traditional Name: N-[3-(4-nitroanilino)propyl]-2-(4-phenylpiperazino)acetamide Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NCCCNC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC(=O)NCCCNC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C21H27N5O3/c27-21(17-24-13-15-25(16-14-24)19-5-2-1-3-6-19)23-12-4-11-22-18-7-9-20(10-8-18)26(28)29/h1-3,5-10,22H,4,11-17H2,(H,23,27)