4-bromanyl-N-[6,7-dimethoxy-1-methyl-3-oxidanylidene-4-(2-oxidanylidene-2-phenylazanyl-ethyl)isoquinolin-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[6,7-dimethoxy-1-methyl-3-oxidanylidene-4-(2-oxidanylidene-2-phenylazanyl-ethyl)isoquinolin-2-yl]benzamide Openeye Name: N-[4-(2-anilino-2-oxo-ethyl)-6,7-dimethoxy-1-methyl-3-oxo-2-isoquinolyl]-4-bromo-benzamide CAS Name: N-[4-(2-anilino-2-oxoethyl)-6,7-dimethoxy-1-methyl-3-oxo-2-isoquinolinyl]-4-bromobenzamide IUPAC Name: N-[4-(2-anilino-2-oxoethyl)-6,7-dimethoxy-1-methyl-3-oxoisoquinolin-2-yl]-4-bromobenzamide Traditional Name: N-[4-(2-anilino-2-keto-ethyl)-3-keto-6,7-dimethoxy-1-methyl-2-isoquinolyl]-4-bromo-benzamide Formula: C27H24BrN3O5 MolecularWeight: 550.40056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=CC2=C(C(=O)N1NC(=O)C3=CC=C(C=C3)Br)CC(=O)NC4=CC=CC=C4)OC)OC

Isomeric SMILES

CC1=C2C=C(C(=CC2=C(C(=O)N1NC(=O)C3=CC=C(C=C3)Br)CC(=O)NC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C27H24BrN3O5/c1-16-20-13-23(35-2)24(36-3)14-21(20)22(15-25(32)29-19-7-5-4-6-8-19)27(34)31(16)30-26(33)17-9-11-18(28)12-10-17/h4-14H,15H2,1-3H3,(H,29,32)(H,30,33)