(2-bromophenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (2-bromophenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (2-bromophenyl)methyl-[2-[(1-ethoxycarbonyl-4-piperidyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (2-bromophenyl)methyl-[2-[(1-ethoxycarbonyl-4-piperidinyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (2-bromophenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: (2-bromobenzyl)-[2-[(1-carbethoxy-4-piperidyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C18H27BrN3O3+ MolecularWeight: 413.32928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](C)CC2=CC=CC=C2Br

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](C)CC2=CC=CC=C2Br

InChI

InChI=1S/C18H26BrN3O3/c1-3-25-18(24)22-10-8-15(9-11-22)20-17(23)13-21(2)12-14-6-4-5-7-16(14)19/h4-7,15H,3,8-13H2,1-2H3,(H,20,23)/p+1