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

Systemtic Name: 2-(1-methylpyrrolidin-2-yl)ethyl N-[3-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]phenyl]carbamate Openeye Name: 2-(1-methylpyrrolidin-2-yl)ethyl 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-(1-methyl-2-pyrrolidinyl)ethyl ester IUPAC Name: 2-(1-methylpyrrolidin-2-yl)ethyl 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-(1-methylpyrrolidin-2-yl)ethyl ester Formula: C22H32N4O3 MolecularWeight: 400.51448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC(=CC=C1)NC(=O)OCCC2CCCN2C)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC(=CC=C1)NC(=O)OCCC2CCCN2C)C(=O)NCC#N

InChI

InChI=1S/C22H32N4O3/c1-16(2)14-20(21(27)24-11-10-23)17-6-4-7-18(15-17)25-22(28)29-13-9-19-8-5-12-26(19)3/h4,6-7,15-16,19-20H,5,8-9,11-14H2,1-3H3,(H,24,27)(H,25,28)