2-[[(4-bromophenyl)-methyl-amino]methyl]-3-chloranyl-naphthalene-1,4-dione

Systemtic Name: 2-[[(4-bromophenyl)-methyl-amino]methyl]-3-chloranyl-naphthalene-1,4-dione Openeye Name: 2-[(4-bromo-N-methyl-anilino)methyl]-3-chloro-naphthalene-1,4-dione CAS Name: 2-[(4-bromo-N-methylanilino)methyl]-3-chloronaphthalene-1,4-dione IUPAC Name: 2-[(4-bromo-N-methylanilino)methyl]-3-chloronaphthalene-1,4-dione Traditional Name: 2-[(4-bromo-N-methyl-anilino)methyl]-3-chloro-1,4-naphthoquinone Formula: C18H13BrClNO2 MolecularWeight: 390.65832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=O)C2=CC=CC=C2C1=O)Cl)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(CC1=C(C(=O)C2=CC=CC=C2C1=O)Cl)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H13BrClNO2/c1-21(12-8-6-11(19)7-9-12)10-15-16(20)18(23)14-5-3-2-4-13(14)17(15)22/h2-9H,10H2,1H3