4-[[(3-bromophenyl)amino]methyl]-6-chloranyl-7-methyl-chromen-2-one

Systemtic Name: 4-[[(3-bromophenyl)amino]methyl]-6-chloranyl-7-methyl-chromen-2-one Openeye Name: 4-[(3-bromoanilino)methyl]-6-chloro-7-methyl-chromen-2-one CAS Name: 4-[(3-bromoanilino)methyl]-6-chloro-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[(3-bromoanilino)methyl]-6-chloro-7-methylchromen-2-one Traditional Name: 4-[(3-bromoanilino)methyl]-6-chloro-7-methyl-coumarin Formula: C17H13BrClNO2 MolecularWeight: 378.64762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3=CC(=CC=C3)Br)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC3=CC(=CC=C3)Br)Cl

InChI

InChI=1S/C17H13BrClNO2/c1-10-5-16-14(8-15(10)19)11(6-17(21)22-16)9-20-13-4-2-3-12(18)7-13/h2-8,20H,9H2,1H3