N-[2-(1-adamantyl)ethyl]-4-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzamide

Systemtic Name: N-[2-(1-adamantyl)ethyl]-4-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzamide Openeye Name: N-[2-(1-adamantyl)ethyl]-4-[2-(4-bromoanilino)-2-oxo-ethoxy]-3-methoxy-benzamide CAS Name: N-[2-(1-adamantyl)ethyl]-4-[2-(4-bromoanilino)-2-oxoethoxy]-3-methoxybenzamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-4-[2-(4-bromoanilino)-2-oxoethoxy]-3-methoxybenzamide Traditional Name: N-[2-(1-adamantyl)ethyl]-4-[2-(4-bromoanilino)-2-keto-ethoxy]-3-methoxy-benzamide Formula: C28H33BrN2O4 MolecularWeight: 541.47662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCCC23CC4CC(C2)CC(C4)C3)OCC(=O)NC5=CC=C(C=C5)Br

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCCC23CC4CC(C2)CC(C4)C3)OCC(=O)NC5=CC=C(C=C5)Br

InChI

InChI=1S/C28H33BrN2O4/c1-34-25-13-21(2-7-24(25)35-17-26(32)31-23-5-3-22(29)4-6-23)27(33)30-9-8-28-14-18-10-19(15-28)12-20(11-18)16-28/h2-7,13,18-20H,8-12,14-17H2,1H3,(H,30,33)(H,31,32)