N-[1-[1-(3-bromophenyl)carbonylpiperidin-4-yl]-2-(cyclopropylamino)-2-oxidanylidene-ethyl]-4-methoxy-benzamide

Systemtic Name: N-[1-[1-(3-bromophenyl)carbonylpiperidin-4-yl]-2-(cyclopropylamino)-2-oxidanylidene-ethyl]-4-methoxy-benzamide Openeye Name: N-[1-[1-(3-bromobenzoyl)-4-piperidyl]-2-(cyclopropylamino)-2-oxo-ethyl]-4-methoxy-benzamide CAS Name: N-[1-[1-[(3-bromophenyl)-oxomethyl]-4-piperidinyl]-2-(cyclopropylamino)-2-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[1-[1-(3-bromobenzoyl)piperidin-4-yl]-2-(cyclopropylamino)-2-oxoethyl]-4-methoxybenzamide Traditional Name: N-[1-[1-(3-bromobenzoyl)-4-piperidyl]-2-(cyclopropylamino)-2-keto-ethyl]-4-methoxy-benzamide Formula: C25H28BrN3O4 MolecularWeight: 514.41152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(C2CCN(CC2)C(=O)C3=CC(=CC=C3)Br)C(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(C2CCN(CC2)C(=O)C3=CC(=CC=C3)Br)C(=O)NC4CC4

InChI

InChI=1S/C25H28BrN3O4/c1-33-21-9-5-17(6-10-21)23(30)28-22(24(31)27-20-7-8-20)16-11-13-29(14-12-16)25(32)18-3-2-4-19(26)15-18/h2-6,9-10,15-16,20,22H,7-8,11-14H2,1H3,(H,27,31)(H,28,30)