N-(1-adamantylmethyl)-2-chloranyl-5-piperazin-1-yl-benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-piperazin-1-yl-benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-piperazin-1-yl-benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-(1-piperazinyl)benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-piperazin-1-ylbenzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-piperazino-benzamide Formula: C22H30ClN3O MolecularWeight: 387.9461

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1)C2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30ClN3O/c23-20-2-1-18(26-5-3-24-4-6-26)10-19(20)21(27)25-14-22-11-15-7-16(12-22)9-17(8-15)13-22/h1-2,10,15-17,24H,3-9,11-14H2,(H,25,27)