[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(phenylmethyl)-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate

Systemtic Name: [2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(phenylmethyl)-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate Openeye Name: [2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl] 2-benzyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate CAS Name: 2-(phenylmethyl)-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid [2-(4-bromo-3-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-methylanilino)-2-oxoethyl] 2-benzyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylate Traditional Name: 2-benzyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carboxylic acid [2-(4-bromo-3-methyl-anilino)-2-keto-ethyl] ester Formula: C29H26BrN3O3 MolecularWeight: 544.43904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)COC(=O)C2=C3CN(CCC3=NC4=CC=CC=C42)CC5=CC=CC=C5)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)COC(=O)C2=C3CN(CCC3=NC4=CC=CC=C42)CC5=CC=CC=C5)Br

InChI

InChI=1S/C29H26BrN3O3/c1-19-15-21(11-12-24(19)30)31-27(34)18-36-29(35)28-22-9-5-6-10-25(22)32-26-13-14-33(17-23(26)28)16-20-7-3-2-4-8-20/h2-12,15H,13-14,16-18H2,1H3,(H,31,34)