4-[[[(1R)-1-(4-bromophenyl)propyl]amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[[(1R)-1-(4-bromophenyl)propyl]amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[[(1R)-1-(4-bromophenyl)propyl]amino]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[[(1R)-1-(4-bromophenyl)propyl]amino]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[[(1R)-1-(4-bromophenyl)propyl]amino]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[[(1R)-1-(4-bromophenyl)propyl]amino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NCC2=CC(=O)OC3=C2C=CC(=C3C)O

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)Br)NCC2=CC(=O)OC3=C2C=CC(=C3C)O

InChI

InChI=1S/C20H20BrNO3/c1-3-17(13-4-6-15(21)7-5-13)22-11-14-10-19(24)25-20-12(2)18(23)9-8-16(14)20/h4-10,17,22-23H,3,11H2,1-2H3/t17-/m1/s1