N-(1-adamantylmethyl)-2-chloranyl-3-piperazin-1-yl-benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-3-piperazin-1-yl-benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-3-piperazin-1-yl-benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-3-(1-piperazinyl)benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-3-piperazin-1-ylbenzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-3-piperazino-benzamide Formula: C22H30ClN3O MolecularWeight: 387.9461

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC(=C2Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1)C2=CC=CC(=C2Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

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