[[3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)phenyl]carbonylamino] benzoate

Systemtic Name: [[3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)phenyl]carbonylamino] benzoate Openeye Name: [[3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoyl]amino] benzoate CAS Name: benzoic acid [[[3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)phenyl]-oxomethyl]amino] ester IUPAC Name: [[3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoyl]amino] benzoate Traditional Name: benzoic acid [[3-(1-adamantyl)-4-(1-methoxyethoxymethoxy)benzoyl]amino] ester Formula: C28H33NO6 MolecularWeight: 479.56472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OCOC1=C(C=C(C=C1)C(=O)NOC(=O)C2=CC=CC=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(OC)OCOC1=C(C=C(C=C1)C(=O)NOC(=O)C2=CC=CC=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H33NO6/c1-18(32-2)33-17-34-25-9-8-23(26(30)29-35-27(31)22-6-4-3-5-7-22)13-24(25)28-14-19-10-20(15-28)12-21(11-19)16-28/h3-9,13,18-21H,10-12,14-17H2,1-2H3,(H,29,30)