(3R,4S)-6-methyl-3-phenyl-4-phenylselanyl-3,4-dihydro-2H-isoquinolin-1-one

Systemtic Name: (3R,4S)-6-methyl-3-phenyl-4-phenylselanyl-3,4-dihydro-2H-isoquinolin-1-one Openeye Name: (3R,4S)-6-methyl-3-phenyl-4-phenylselanyl-3,4-dihydro-2H-isoquinolin-1-one CAS Name: (3R,4S)-6-methyl-3-phenyl-4-(phenylseleno)-3,4-dihydro-2H-isoquinolin-1-one IUPAC Name: (3R,4S)-6-methyl-3-phenyl-4-phenylselanyl-3,4-dihydro-2H-isoquinolin-1-one Traditional Name: (3R,4S)-6-methyl-3-phenyl-4-(phenylseleno)-3,4-dihydroisocarbostyril Formula: C22H19NOSe MolecularWeight: 392.35236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)NC(C2[Se]C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N[C@@H]([C@H]2[Se]C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H19NOSe/c1-15-12-13-18-19(14-15)21(25-17-10-6-3-7-11-17)20(23-22(18)24)16-8-4-2-5-9-16/h2-14,20-21H,1H3,(H,23,24)/t20-,21+/m1/s1