N-(4-azanyl-2-chloranyl-phenyl)-N-methyl-2-(3-propylpyrrolidin-1-yl)ethanamide; pentanamide; chloride

Systemtic Name: N-(4-azanyl-2-chloranyl-phenyl)-N-methyl-2-(3-propylpyrrolidin-1-yl)ethanamide; pentanamide; chloride Openeye Name: N-(4-amino-2-chloro-phenyl)-N-methyl-2-(3-propylpyrrolidin-1-yl)acetamide; pentanamide; chloride CAS Name: N-(4-amino-2-chlorophenyl)-N-methyl-2-(3-propyl-1-pyrrolidinyl)acetamide; pentanamide; chloride IUPAC Name: N-(4-amino-2-chlorophenyl)-N-methyl-2-(3-propylpyrrolidin-1-yl)acetamide; pentanamide; chloride Traditional Name: N-(4-amino-2-chloro-phenyl)-N-methyl-2-(3-propylpyrrolidino)acetamide; valeramide; chloride Formula: C21H35Cl2N4O2- MolecularWeight: 446.4342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N.CCCC1CCN(C1)CC(=O)N(C)C2=C(C=C(C=C2)N)Cl.[Cl-]

Isomeric SMILES

CCCCC(=O)N.CCCC1CCN(C1)CC(=O)N(C)C2=C(C=C(C=C2)N)Cl.[Cl-]

InChI

InChI=1S/C16H24ClN3O.C5H11NO.ClH/c1-3-4-12-7-8-20(10-12)11-16(21)19(2)15-6-5-13(18)9-14(15)17;1-2-3-4-5(6)7;/h5-6,9,12H,3-4,7-8,10-11,18H2,1-2H3;2-4H2,1H3,(H2,6,7);1H/p-1