butyl N-[6-(butoxycarbonylamino)-3-phenyldiazenyl-pyridin-2-yl]carbamate

Systemtic Name: butyl N-[6-(butoxycarbonylamino)-3-phenyldiazenyl-pyridin-2-yl]carbamate Openeye Name: butyl N-[6-(butoxycarbonylamino)-3-phenylazo-2-pyridyl]carbamate CAS Name: N-[6-[[butoxy(oxo)methyl]amino]-3-phenyldiazenyl-2-pyridinyl]carbamic acid butyl ester IUPAC Name: butyl N-[6-(butoxycarbonylamino)-3-phenyldiazenylpyridin-2-yl]carbamate Traditional Name: N-[6-(butoxycarbonylamino)-3-phenylazo-2-pyridyl]carbamic acid butyl ester Formula: C21H27N5O4 MolecularWeight: 413.47018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=NC(=C(C=C1)N=NC2=CC=CC=C2)NC(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)NC1=NC(=C(C=C1)N=NC2=CC=CC=C2)NC(=O)OCCCC

InChI

InChI=1S/C21H27N5O4/c1-3-5-14-29-20(27)23-18-13-12-17(26-25-16-10-8-7-9-11-16)19(22-18)24-21(28)30-15-6-4-2/h7-13H,3-6,14-15H2,1-2H3,(H2,22,23,24,27,28)