1-(1,3-benzodioxol-5-yl)-1-[(4-bromophenyl)amino]-5-(6-methoxynaphthalen-2-yl)pentan-3-one

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-1-[(4-bromophenyl)amino]-5-(6-methoxynaphthalen-2-yl)pentan-3-one Openeye Name: 1-(1,3-benzodioxol-5-yl)-1-(4-bromoanilino)-5-(6-methoxy-2-naphthyl)pentan-3-one CAS Name: 1-(1,3-benzodioxol-5-yl)-1-(4-bromoanilino)-5-(6-methoxy-2-naphthalenyl)-3-pentanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-1-(4-bromoanilino)-5-(6-methoxynaphthalen-2-yl)pentan-3-one Traditional Name: 1-(1,3-benzodioxol-5-yl)-1-(4-bromoanilino)-5-(6-methoxy-2-naphthyl)pentan-3-one Formula: C29H26BrNO4 MolecularWeight: 532.42504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)CCC(=O)CC(C3=CC4=C(C=C3)OCO4)NC5=CC=C(C=C5)Br

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)CCC(=O)CC(C3=CC4=C(C=C3)OCO4)NC5=CC=C(C=C5)Br

InChI

InChI=1S/C29H26BrNO4/c1-33-26-12-5-20-14-19(2-4-21(20)15-26)3-11-25(32)17-27(31-24-9-7-23(30)8-10-24)22-6-13-28-29(16-22)35-18-34-28/h2,4-10,12-16,27,31H,3,11,17-18H2,1H3