N-[6-methyl-2-(3-nitrophenyl)benzotriazol-5-yl]butanamide

Systemtic Name: N-[6-methyl-2-(3-nitrophenyl)benzotriazol-5-yl]butanamide Openeye Name: N-[6-methyl-2-(3-nitrophenyl)benzotriazol-5-yl]butanamide CAS Name: N-[6-methyl-2-(3-nitrophenyl)-5-benzotriazolyl]butanamide IUPAC Name: N-[6-methyl-2-(3-nitrophenyl)benzotriazol-5-yl]butanamide Traditional Name: N-[6-methyl-2-(3-nitrophenyl)benzotriazol-5-yl]butyramide Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC2=NN(N=C2C=C1C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=CC2=NN(N=C2C=C1C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O3/c1-3-5-17(23)18-14-10-16-15(8-11(14)2)19-21(20-16)12-6-4-7-13(9-12)22(24)25/h4,6-10H,3,5H2,1-2H3,(H,18,23)