ethyl 1-[2-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(4-methyl-3-morpholinosulfonyl-anilino)-2-oxo-ethyl]piperidine-3-carboxylate CAS Name: 1-[2-[4-methyl-3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]piperidine-3-carboxylate Traditional Name: 1-[2-keto-2-(4-methyl-3-morpholinosulfonyl-anilino)ethyl]nipecotic acid ethyl ester Formula: C21H31N3O6S MolecularWeight: 453.55234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC(=O)NC2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H31N3O6S/c1-3-30-21(26)17-5-4-8-23(14-17)15-20(25)22-18-7-6-16(2)19(13-18)31(27,28)24-9-11-29-12-10-24/h6-7,13,17H,3-5,8-12,14-15H2,1-2H3,(H,22,25)