[4-[(3-chloranyl-1-adamantyl)carbonyl]piperazin-1-yl]-(3-methoxyphenyl)methanone

Systemtic Name: [4-[(3-chloranyl-1-adamantyl)carbonyl]piperazin-1-yl]-(3-methoxyphenyl)methanone Openeye Name: [4-(3-chloroadamantane-1-carbonyl)piperazin-1-yl]-(3-methoxyphenyl)methanone CAS Name: [4-[(3-chloro-1-adamantyl)-oxomethyl]-1-piperazinyl]-(3-methoxyphenyl)methanone IUPAC Name: [4-(3-chloroadamantane-1-carbonyl)piperazin-1-yl]-(3-methoxyphenyl)methanone Traditional Name: [4-(3-chloroadamantane-1-carbonyl)piperazino]-(3-methoxyphenyl)methanone Formula: C23H29ClN2O3 MolecularWeight: 416.94096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C23H29ClN2O3/c1-29-19-4-2-3-18(10-19)20(27)25-5-7-26(8-6-25)21(28)22-11-16-9-17(12-22)14-23(24,13-16)15-22/h2-4,10,16-17H,5-9,11-15H2,1H3