6-[(7-bromanyl-1,5-dihydro-1,5-naphthyridin-4-yl)imino]-2-[(3-methylpiperidin-1-yl)methyl]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(7-bromanyl-1,5-dihydro-1,5-naphthyridin-4-yl)imino]-2-[(3-methylpiperidin-1-yl)methyl]cyclohexa-2,4-dien-1-one Openeye Name: 6-[(7-bromo-1,5-dihydro-1,5-naphthyridin-4-yl)imino]-2-[(3-methyl-1-piperidyl)methyl]cyclohexa-2,4-dien-1-one CAS Name: 6-[(7-bromo-1,5-dihydro-1,5-naphthyridin-4-yl)imino]-2-[(3-methyl-1-piperidinyl)methyl]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(7-bromo-1,5-dihydro-1,5-naphthyridin-4-yl)imino]-2-[(3-methylpiperidin-1-yl)methyl]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(7-bromo-1,5-dihydro-1,5-naphthyridin-4-yl)imino]-2-[(3-methylpiperidino)methyl]cyclohexa-2,4-dien-1-one Formula: C21H23BrN4O MolecularWeight: 427.33752

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CC2=CC=CC(=NC3=C4C(=CC(=CN4)Br)NC=C3)C2=O

Isomeric SMILES

CC1CCCN(C1)CC2=CC=CC(=NC3=C4C(=CC(=CN4)Br)NC=C3)C2=O

InChI

InChI=1S/C21H23BrN4O/c1-14-4-3-9-26(12-14)13-15-5-2-6-18(21(15)27)25-17-7-8-23-19-10-16(22)11-24-20(17)19/h2,5-8,10-11,14,23-24H,3-4,9,12-13H2,1H3