N-(3-chloranyl-4-methyl-phenyl)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-benzoyl-N-(3-chloro-4-methyl-phenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-benzoyl-N-(3-chloro-4-methylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-benzoyl-N-(3-chloro-4-methylphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-benzoyl-N-(3-chloro-4-methyl-phenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C24H21ClN2O2 MolecularWeight: 404.88874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2C(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C24H21ClN2O2/c1-16-11-12-20(14-21(16)25)26-23(28)22-13-18-9-5-6-10-19(18)15-27(22)24(29)17-7-3-2-4-8-17/h2-12,14,22H,13,15H2,1H3,(H,26,28)