3-(4-nitrophenoxy)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]propanamide

Systemtic Name: 3-(4-nitrophenoxy)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]propanamide Openeye Name: 3-(4-nitrophenoxy)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]propanamide CAS Name: 3-(4-nitrophenoxy)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]propanamide IUPAC Name: 3-(4-nitrophenoxy)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]propanamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-3-(4-nitrophenoxy)propionamide Formula: C18H19N5O5 MolecularWeight: 385.37396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)CCOC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)CCOC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O5/c24-17(7-10-28-15-4-2-14(3-5-15)23(26)27)21-13-1-6-16(20-11-13)22-9-8-19-18(25)12-22/h1-6,11H,7-10,12H2,(H,19,25)(H,21,24)