N-[4-(1-adamantyl)phenyl]-3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-[4-(1-adamantyl)phenyl]-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: N-[4-(1-adamantyl)phenyl]-3-(1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-[4-(1-adamantyl)phenyl]-3-phthalimido-propionamide Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)CCN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)CCN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C27H28N2O3/c30-24(9-10-29-25(31)22-3-1-2-4-23(22)26(29)32)28-21-7-5-20(6-8-21)27-14-17-11-18(15-27)13-19(12-17)16-27/h1-8,17-19H,9-16H2,(H,28,30)