2-morpholin-4-ylethyl N-[3-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]phenyl]carbamate

Systemtic Name: 2-morpholin-4-ylethyl N-[3-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]phenyl]carbamate Openeye Name: 2-morpholinoethyl N-[3-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]phenyl]carbamate CAS Name: N-[3-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]phenyl]carbamic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl N-[3-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]phenyl]carbamate Traditional Name: N-[3-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]phenyl]carbamic acid 2-morpholinoethyl ester Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC(=CC=C1)NC(=O)OCCN2CCOCC2)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC(=CC=C1)NC(=O)OCCN2CCOCC2)C(=O)NCC#N

InChI

InChI=1S/C21H30N4O4/c1-16(2)14-19(20(26)23-7-6-22)17-4-3-5-18(15-17)24-21(27)29-13-10-25-8-11-28-12-9-25/h3-5,15-16,19H,7-14H2,1-2H3,(H,23,26)(H,24,27)