ethyl N-[2-cyano-4-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl]carbamate hydrochloride

Systemtic Name: ethyl N-[2-cyano-4-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl]carbamate hydrochloride Openeye Name: ethyl N-[2-cyano-4-[1-hydroxy-2-(isopropylamino)ethyl]phenyl]carbamate hydrochloride CAS Name: N-[2-cyano-4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]carbamic acid ethyl ester hydrochloride IUPAC Name: ethyl N-[2-cyano-4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]carbamate hydrochloride Traditional Name: N-[2-cyano-4-[1-hydroxy-2-(isopropylamino)ethyl]phenyl]carbamic acid ethyl ester hydrochloride Formula: C15H22ClN3O3 MolecularWeight: 327.80648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=C(C=C(C=C1)C(CNC(C)C)O)C#N.Cl

Isomeric SMILES

CCOC(=O)NC1=C(C=C(C=C1)C(CNC(C)C)O)C#N.Cl

InChI

InChI=1S/C15H21N3O3.ClH/c1-4-21-15(20)18-13-6-5-11(7-12(13)8-16)14(19)9-17-10(2)3;/h5-7,10,14,17,19H,4,9H2,1-3H3,(H,18,20);1H