N-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]-N-(4-methylphenyl)adamantane-1-carboxamide

Systemtic Name: N-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]-N-(4-methylphenyl)adamantane-1-carboxamide Openeye Name: N-[4-(1,3-dioxoisoindolin-2-yl)butyl]-N-(p-tolyl)adamantane-1-carboxamide CAS Name: N-[4-(1,3-dioxo-2-isoindolyl)butyl]-N-(4-methylphenyl)-1-adamantanecarboxamide IUPAC Name: N-[4-(1,3-dioxoisoindol-2-yl)butyl]-N-(4-methylphenyl)adamantane-1-carboxamide Traditional Name: N-(4-phthalimidobutyl)-N-(p-tolyl)adamantane-1-carboxamide Formula: C30H34N2O3 MolecularWeight: 470.60256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC=C(C=C1)N(CCCCN2C(=O)C3=CC=CC=C3C2=O)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C30H34N2O3/c1-20-8-10-24(11-9-20)31(29(35)30-17-21-14-22(18-30)16-23(15-21)19-30)12-4-5-13-32-27(33)25-6-2-3-7-26(25)28(32)34/h2-3,6-11,21-23H,4-5,12-19H2,1H3