4-[[(4-bromanyl-3-methyl-phenyl)amino]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[(4-bromanyl-3-methyl-phenyl)amino]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[(4-bromo-3-methyl-anilino)methyl]-7-methoxy-chromen-2-one CAS Name: 4-[(4-bromo-3-methylanilino)methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(4-bromo-3-methylanilino)methyl]-7-methoxychromen-2-one Traditional Name: 4-[(4-bromo-3-methyl-anilino)methyl]-7-methoxy-coumarin Formula: C18H16BrNO3 MolecularWeight: 374.22854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NCC2=CC(=O)OC3=C2C=CC(=C3)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NCC2=CC(=O)OC3=C2C=CC(=C3)OC)Br

InChI

InChI=1S/C18H16BrNO3/c1-11-7-13(3-6-16(11)19)20-10-12-8-18(21)23-17-9-14(22-2)4-5-15(12)17/h3-9,20H,10H2,1-2H3