[1-(2-methoxyethanoyl)piperidin-3-yl] N-azanyl-N-(7-chloranylcinnolin-3-yl)carbonyl-carbamate

Systemtic Name: [1-(2-methoxyethanoyl)piperidin-3-yl] N-azanyl-N-(7-chloranylcinnolin-3-yl)carbonyl-carbamate Openeye Name: [1-(2-methoxyacetyl)-3-piperidyl] N-amino-N-(7-chlorocinnoline-3-carbonyl)carbamate CAS Name: N-amino-N-[(7-chloro-3-cinnolinyl)-oxomethyl]carbamic acid [1-(2-methoxy-1-oxoethyl)-3-piperidinyl] ester IUPAC Name: [1-(2-methoxyacetyl)piperidin-3-yl] N-amino-N-(7-chlorocinnoline-3-carbonyl)carbamate Traditional Name: N-amino-N-(7-chlorocinnoline-3-carbonyl)carbamic acid [1-(2-methoxyacetyl)-3-piperidyl] ester Formula: C18H20ClN5O5 MolecularWeight: 421.8349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCCC(C1)OC(=O)N(C(=O)C2=NN=C3C=C(C=CC3=C2)Cl)N

Isomeric SMILES

COCC(=O)N1CCCC(C1)OC(=O)N(C(=O)C2=NN=C3C=C(C=CC3=C2)Cl)N

InChI

InChI=1S/C18H20ClN5O5/c1-28-10-16(25)23-6-2-3-13(9-23)29-18(27)24(20)17(26)15-7-11-4-5-12(19)8-14(11)21-22-15/h4-5,7-8,13H,2-3,6,9-10,20H2,1H3