N-[2-(6-bromanyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]-4-methyl-piperazine-1-carboxamide; (E)-but-2-enedioic acid

Systemtic Name: N-[2-(6-bromanyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]-4-methyl-piperazine-1-carboxamide; (E)-but-2-enedioic acid Openeye Name: N-[2-(6-bromo-3,4-dihydro-2H-quinolin-1-yl)phenyl]-4-methyl-piperazine-1-carboxamide; fumaric acid CAS Name: N-[2-(6-bromo-3,4-dihydro-2H-quinolin-1-yl)phenyl]-4-methyl-1-piperazinecarboxamide; (E)-2-butenedioic acid IUPAC Name: N-[2-(6-bromo-3,4-dihydro-2H-quinolin-1-yl)phenyl]-4-methylpiperazine-1-carboxamide; (E)-but-2-enedioic acid Traditional Name: N-[2-(6-bromo-3,4-dihydro-2H-quinolin-1-yl)phenyl]-4-methyl-piperazine-1-carboxamide; fumaric acid Formula: C25H29BrN4O5 MolecularWeight: 545.42556

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)NC2=CC=CC=C2N3CCCC4=C3C=CC(=C4)Br.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(=O)NC2=CC=CC=C2N3CCCC4=C3C=CC(=C4)Br.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C21H25BrN4O.C4H4O4/c1-24-11-13-25(14-12-24)21(27)23-18-6-2-3-7-20(18)26-10-4-5-16-15-17(22)8-9-19(16)26;5-3(6)1-2-4(7)8/h2-3,6-9,15H,4-5,10-14H2,1H3,(H,23,27);1-2H,(H,5,6)(H,7,8)/b;2-1+