ethyl N-[6-azanyl-5-nitro-4-[(2-oxidanylidene-4-phenyl-butyl)amino]pyridin-2-yl]carbamate

Systemtic Name: ethyl N-[6-azanyl-5-nitro-4-[(2-oxidanylidene-4-phenyl-butyl)amino]pyridin-2-yl]carbamate Openeye Name: ethyl N-[6-amino-5-nitro-4-[(2-oxo-4-phenyl-butyl)amino]-2-pyridyl]carbamate CAS Name: N-[6-amino-5-nitro-4-[(2-oxo-4-phenylbutyl)amino]-2-pyridinyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-amino-5-nitro-4-[(2-oxo-4-phenylbutyl)amino]pyridin-2-yl]carbamate Traditional Name: N-[6-amino-4-[(2-keto-4-phenyl-butyl)amino]-5-nitro-2-pyridyl]carbamic acid ethyl ester Formula: C18H21N5O5 MolecularWeight: 387.38984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC(=C(C(=C1)NCC(=O)CCC2=CC=CC=C2)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)NC1=NC(=C(C(=C1)NCC(=O)CCC2=CC=CC=C2)[N+](=O)[O-])N

InChI

InChI=1S/C18H21N5O5/c1-2-28-18(25)22-15-10-14(16(23(26)27)17(19)21-15)20-11-13(24)9-8-12-6-4-3-5-7-12/h3-7,10H,2,8-9,11H2,1H3,(H4,19,20,21,22,25)