N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-(4-butylphenyl)-5-benzotriazolyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-3-nitro-4-piperidino-benzamide Formula: C28H30N6O3 MolecularWeight: 498.5762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C28H30N6O3/c1-2-3-7-20-8-12-23(13-9-20)33-30-24-14-11-22(19-25(24)31-33)29-28(35)21-10-15-26(27(18-21)34(36)37)32-16-5-4-6-17-32/h8-15,18-19H,2-7,16-17H2,1H3,(H,29,35)