[4-[(3-chloranyl-1-adamantyl)carbonyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone

Systemtic Name: [4-[(3-chloranyl-1-adamantyl)carbonyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Openeye Name: [4-(3-chloroadamantane-1-carbonyl)piperazin-1-yl]-(4-isopropylphenyl)methanone CAS Name: [4-[(3-chloro-1-adamantyl)-oxomethyl]-1-piperazinyl]-(4-propan-2-ylphenyl)methanone IUPAC Name: [4-(3-chloroadamantane-1-carbonyl)piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Traditional Name: [4-(3-chloroadamantane-1-carbonyl)piperazino]-p-cumenyl-methanone Formula: C25H33ClN2O2 MolecularWeight: 428.99472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C25H33ClN2O2/c1-17(2)20-3-5-21(6-4-20)22(29)27-7-9-28(10-8-27)23(30)24-12-18-11-19(13-24)15-25(26,14-18)16-24/h3-6,17-19H,7-16H2,1-2H3