methyl 3-methyl-2-[[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]carbonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]carbonylamino]butanoate Openeye Name: methyl 3-methyl-2-[[4-[4-(2-nitrophenyl)thiazol-2-yl]piperidine-1-carbonyl]amino]butanoate CAS Name: 3-methyl-2-[[[4-[4-(2-nitrophenyl)-2-thiazolyl]-1-piperidinyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[4-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]piperidine-1-carbonyl]amino]butanoate Traditional Name: 3-methyl-2-[[4-[4-(2-nitrophenyl)thiazol-2-yl]piperidine-1-carbonyl]amino]butyric acid methyl ester Formula: C21H26N4O5S MolecularWeight: 446.51994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)N1CCC(CC1)C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)N1CCC(CC1)C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O5S/c1-13(2)18(20(26)30-3)23-21(27)24-10-8-14(9-11-24)19-22-16(12-31-19)15-6-4-5-7-17(15)25(28)29/h4-7,12-14,18H,8-11H2,1-3H3,(H,23,27)