(8S,9S)-9-[(2-bromanyl-4-methyl-phenyl)amino]-4-methyl-8-oxidanyl-7,8,9,10-tetrahydrobenzo[h]chromen-2-one

Systemtic Name: (8S,9S)-9-[(2-bromanyl-4-methyl-phenyl)amino]-4-methyl-8-oxidanyl-7,8,9,10-tetrahydrobenzo[h]chromen-2-one Openeye Name: (8S,9S)-9-(2-bromo-4-methyl-anilino)-8-hydroxy-4-methyl-7,8,9,10-tetrahydrobenzo[h]chromen-2-one CAS Name: (8S,9S)-9-(2-bromo-4-methylanilino)-8-hydroxy-4-methyl-7,8,9,10-tetrahydrobenzo[h][1]benzopyran-2-one IUPAC Name: (8S,9S)-9-(2-bromo-4-methylanilino)-8-hydroxy-4-methyl-7,8,9,10-tetrahydrobenzo[h]chromen-2-one Traditional Name: (8S,9S)-9-(2-bromo-4-methyl-anilino)-8-hydroxy-4-methyl-7,8,9,10-tetrahydrobenzo[h]chromen-2-one Formula: C21H20BrNO3 MolecularWeight: 414.2924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2CC3=C(CC2O)C=CC4=C3OC(=O)C=C4C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)N[C@H]2CC3=C(C[C@@H]2O)C=CC4=C3OC(=O)C=C4C)Br

InChI

InChI=1S/C21H20BrNO3/c1-11-3-6-17(16(22)7-11)23-18-10-15-13(9-19(18)24)4-5-14-12(2)8-20(25)26-21(14)15/h3-8,18-19,23-24H,9-10H2,1-2H3/t18-,19-/m0/s1