N-[2-[(4-bromophenyl)carbamoyl]-4-chloranyl-6-oxidanyl-phenyl]-2,3-dimethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide

Systemtic Name: N-[2-[(4-bromophenyl)carbamoyl]-4-chloranyl-6-oxidanyl-phenyl]-2,3-dimethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Openeye Name: N-[2-[(4-bromophenyl)carbamoyl]-4-chloro-6-hydroxy-phenyl]-2,3-dimethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide CAS Name: N-[2-[(4-bromoanilino)-oxomethyl]-4-chloro-6-hydroxyphenyl]-2,3-dimethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide IUPAC Name: N-[2-[(4-bromophenyl)carbamoyl]-4-chloro-6-hydroxyphenyl]-2,3-dimethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Traditional Name: N-[2-[(4-bromophenyl)carbamoyl]-4-chloro-6-hydroxy-phenyl]-2,3-dimethyl-3,4-dihydro-1H-isoquinoline-6-carboxamide Formula: C25H23BrClN3O3 MolecularWeight: 528.82542

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(CN1C)C=CC(=C2)C(=O)NC3=C(C=C(C=C3C(=O)NC4=CC=C(C=C4)Br)Cl)O

Isomeric SMILES

CC1CC2=C(CN1C)C=CC(=C2)C(=O)NC3=C(C=C(C=C3C(=O)NC4=CC=C(C=C4)Br)Cl)O

InChI

InChI=1S/C25H23BrClN3O3/c1-14-9-17-10-15(3-4-16(17)13-30(14)2)24(32)29-23-21(11-19(27)12-22(23)31)25(33)28-20-7-5-18(26)6-8-20/h3-8,10-12,14,31H,9,13H2,1-2H3,(H,28,33)(H,29,32)