N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide

Systemtic Name: N-[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Openeye Name: N-[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide CAS Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-1-(2-methyl-1-oxopropyl)-3-piperidinecarboxamide IUPAC Name: N-[2-(4-bromo-2-methylanilino)-2-oxoethyl]-1-(2-methylpropanoyl)piperidine-3-carboxamide Traditional Name: N-[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-1-isobutyryl-nipecotamide Formula: C19H26BrN3O3 MolecularWeight: 424.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2CCCN(C2)C(=O)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)C2CCCN(C2)C(=O)C(C)C

InChI

InChI=1S/C19H26BrN3O3/c1-12(2)19(26)23-8-4-5-14(11-23)18(25)21-10-17(24)22-16-7-6-15(20)9-13(16)3/h6-7,9,12,14H,4-5,8,10-11H2,1-3H3,(H,21,25)(H,22,24)