N-[3-(morpholin-4-ylmethyl)phenyl]-2-(4-nitropyrazol-1-yl)butanamide

Systemtic Name: N-[3-(morpholin-4-ylmethyl)phenyl]-2-(4-nitropyrazol-1-yl)butanamide Openeye Name: N-[3-(morpholinomethyl)phenyl]-2-(4-nitropyrazol-1-yl)butanamide CAS Name: N-[3-(4-morpholinylmethyl)phenyl]-2-(4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[3-(morpholin-4-ylmethyl)phenyl]-2-(4-nitropyrazol-1-yl)butanamide Traditional Name: N-[3-(morpholinomethyl)phenyl]-2-(4-nitropyrazol-1-yl)butyramide Formula: C18H23N5O4 MolecularWeight: 373.40632

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)CN2CCOCC2)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)CN2CCOCC2)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O4/c1-2-17(22-13-16(11-19-22)23(25)26)18(24)20-15-5-3-4-14(10-15)12-21-6-8-27-9-7-21/h3-5,10-11,13,17H,2,6-9,12H2,1H3,(H,20,24)