N-(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[6-methyl-2-(1-naphthalenyl)-5-benzotriazolyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(6-methyl-2-naphthalen-1-ylbenzotriazol-5-yl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]-3-nitro-4-piperidino-benzamide Formula: C29H26N6O3 MolecularWeight: 506.55514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-])C5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-])C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C29H26N6O3/c1-19-16-24-25(32-34(31-24)26-11-7-9-20-8-3-4-10-22(20)26)18-23(19)30-29(36)21-12-13-27(28(17-21)35(37)38)33-14-5-2-6-15-33/h3-4,7-13,16-18H,2,5-6,14-15H2,1H3,(H,30,36)