4-bromanyl-N-[(1-carbamimidoylpiperidin-4-yl)methyl]-3-[2-(2,4-dichlorophenyl)ethoxy]-5-oxidanyl-benzamide

Systemtic Name: 4-bromanyl-N-[(1-carbamimidoylpiperidin-4-yl)methyl]-3-[2-(2,4-dichlorophenyl)ethoxy]-5-oxidanyl-benzamide Openeye Name: 4-bromo-N-[(1-carbamimidoyl-4-piperidyl)methyl]-3-[2-(2,4-dichlorophenyl)ethoxy]-5-hydroxy-benzamide CAS Name: 4-bromo-N-[(1-carbamimidoyl-4-piperidinyl)methyl]-3-[2-(2,4-dichlorophenyl)ethoxy]-5-hydroxybenzamide IUPAC Name: 4-bromo-N-[(1-carbamimidoylpiperidin-4-yl)methyl]-3-[2-(2,4-dichlorophenyl)ethoxy]-5-hydroxybenzamide Traditional Name: N-[(1-amidino-4-piperidyl)methyl]-4-bromo-3-[2-(2,4-dichlorophenyl)ethoxy]-5-hydroxy-benzamide Formula: C22H25BrCl2N4O3 MolecularWeight: 544.2689

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(=O)C2=CC(=C(C(=C2)OCCC3=C(C=C(C=C3)Cl)Cl)Br)O)C(=N)N

Isomeric SMILES

C1CN(CCC1CNC(=O)C2=CC(=C(C(=C2)OCCC3=C(C=C(C=C3)Cl)Cl)Br)O)C(=N)N

InChI

InChI=1S/C22H25BrCl2N4O3/c23-20-18(30)9-15(21(31)28-12-13-3-6-29(7-4-13)22(26)27)10-19(20)32-8-5-14-1-2-16(24)11-17(14)25/h1-2,9-11,13,30H,3-8,12H2,(H3,26,27)(H,28,31)