4-(diphenylmethyl)-N-(10-quinolin-1-ium-1-yldecyl)piperazine-1-carboxamide bromide

Systemtic Name: 4-(diphenylmethyl)-N-(10-quinolin-1-ium-1-yldecyl)piperazine-1-carboxamide bromide Openeye Name: 4-benzhydryl-N-(10-quinolin-1-ium-1-yldecyl)piperazine-1-carboxamide bromide CAS Name: 4-(diphenylmethyl)-N-[10-(1-quinolin-1-iumyl)decyl]-1-piperazinecarboxamide bromide IUPAC Name: 4-benzhydryl-N-(10-quinolin-1-ium-1-yldecyl)piperazine-1-carboxamide bromide Traditional Name: 4-benzhydryl-N-(10-quinolin-1-ium-1-yldecyl)piperazine-1-carboxamide bromide Formula: C37H47BrN4O MolecularWeight: 643.69928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCCCCCCCCC[N+]4=CC=CC5=CC=CC=C54.[Br-]

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCCCCCCCCC[N+]4=CC=CC5=CC=CC=C54.[Br-]

InChI

InChI=1S/C37H46N4O.BrH/c42-37(41-30-28-40(29-31-41)36(33-19-9-7-10-20-33)34-21-11-8-12-22-34)38-25-15-5-3-1-2-4-6-16-26-39-27-17-23-32-18-13-14-24-35(32)39;/h7-14,17-24,27,36H,1-6,15-16,25-26,28-31H2;1H