N-[4-(3-anthracen-9-ylpropoxy)-2-(2,2-dimethoxyethyl)phenyl]-4-bromanyl-benzamide

Systemtic Name: N-[4-(3-anthracen-9-ylpropoxy)-2-(2,2-dimethoxyethyl)phenyl]-4-bromanyl-benzamide Openeye Name: N-[4-[3-(9-anthryl)propoxy]-2-(2,2-dimethoxyethyl)phenyl]-4-bromo-benzamide CAS Name: N-[4-[3-(9-anthracenyl)propoxy]-2-(2,2-dimethoxyethyl)phenyl]-4-bromobenzamide IUPAC Name: N-[4-(3-anthracen-9-ylpropoxy)-2-(2,2-dimethoxyethyl)phenyl]-4-bromobenzamide Traditional Name: N-[4-[3-(9-anthryl)propoxy]-2-(2,2-dimethoxyethyl)phenyl]-4-bromo-benzamide Formula: C34H32BrNO4 MolecularWeight: 598.52618

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=C(C=CC(=C1)OCCCC2=C3C=CC=CC3=CC4=CC=CC=C42)NC(=O)C5=CC=C(C=C5)Br)OC

Isomeric SMILES

COC(CC1=C(C=CC(=C1)OCCCC2=C3C=CC=CC3=CC4=CC=CC=C42)NC(=O)C5=CC=C(C=C5)Br)OC

InChI

InChI=1S/C34H32BrNO4/c1-38-33(39-2)22-26-21-28(17-18-32(26)36-34(37)23-13-15-27(35)16-14-23)40-19-7-12-31-29-10-5-3-8-24(29)20-25-9-4-6-11-30(25)31/h3-6,8-11,13-18,20-21,33H,7,12,19,22H2,1-2H3,(H,36,37)