[4-(2-adamantyl)piperazin-1-yl]-(4-aminophenyl)methanone

Systemtic Name: [4-(2-adamantyl)piperazin-1-yl]-(4-aminophenyl)methanone Openeye Name: [4-(2-adamantyl)piperazin-1-yl]-(4-aminophenyl)methanone CAS Name: [4-(2-adamantyl)-1-piperazinyl]-(4-aminophenyl)methanone IUPAC Name: [4-(2-adamantyl)piperazin-1-yl]-(4-aminophenyl)methanone Traditional Name: [4-(2-adamantyl)piperazino]-(4-aminophenyl)methanone Formula: C21H29N3O MolecularWeight: 339.47446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2C3CC4CC(C3)CC2C4)C(=O)C5=CC=C(C=C5)N

Isomeric SMILES

C1CN(CCN1C2C3CC4CC(C3)CC2C4)C(=O)C5=CC=C(C=C5)N

InChI

InChI=1S/C21H29N3O/c22-19-3-1-16(2-4-19)21(25)24-7-5-23(6-8-24)20-17-10-14-9-15(12-17)13-18(20)11-14/h1-4,14-15,17-18,20H,5-13,22H2