N-[2-(1-adamantyl)ethyl]-5-(3-azanylpyrrolidin-1-yl)-2-chloranyl-benzamide

Systemtic Name: N-[2-(1-adamantyl)ethyl]-5-(3-azanylpyrrolidin-1-yl)-2-chloranyl-benzamide Openeye Name: N-[2-(1-adamantyl)ethyl]-5-(3-aminopyrrolidin-1-yl)-2-chloro-benzamide CAS Name: N-[2-(1-adamantyl)ethyl]-5-(3-amino-1-pyrrolidinyl)-2-chlorobenzamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-5-(3-aminopyrrolidin-1-yl)-2-chlorobenzamide Traditional Name: N-[2-(1-adamantyl)ethyl]-5-(3-aminopyrrolidino)-2-chloro-benzamide Formula: C23H32ClN3O MolecularWeight: 401.97268

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=CC(=C(C=C2)Cl)C(=O)NCCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CC1N)C2=CC(=C(C=C2)Cl)C(=O)NCCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H32ClN3O/c24-21-2-1-19(27-6-3-18(25)14-27)10-20(21)22(28)26-5-4-23-11-15-7-16(12-23)9-17(8-15)13-23/h1-2,10,15-18H,3-9,11-14,25H2,(H,26,28)