5-[3-(2-acetamidoethylamino)propyl]-N-(1-adamantylmethyl)-2-chloranyl-benzamide hydrochloride

Systemtic Name: 5-[3-(2-acetamidoethylamino)propyl]-N-(1-adamantylmethyl)-2-chloranyl-benzamide hydrochloride Openeye Name: 5-[3-(2-acetamidoethylamino)propyl]-N-(1-adamantylmethyl)-2-chloro-benzamide hydrochloride CAS Name: 5-[3-(2-acetamidoethylamino)propyl]-N-(1-adamantylmethyl)-2-chlorobenzamide hydrochloride IUPAC Name: 5-[3-(2-acetamidoethylamino)propyl]-N-(1-adamantylmethyl)-2-chlorobenzamide hydrochloride Traditional Name: 5-[3-(2-acetamidoethylamino)propyl]-N-(1-adamantylmethyl)-2-chloro-benzamide hydrochloride Formula: C25H37Cl2N3O2 MolecularWeight: 482.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNCCCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3.Cl

Isomeric SMILES

CC(=O)NCCNCCCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3.Cl

InChI

InChI=1S/C25H36ClN3O2.ClH/c1-17(30)28-8-7-27-6-2-3-18-4-5-23(26)22(12-18)24(31)29-16-25-13-19-9-20(14-25)11-21(10-19)15-25;/h4-5,12,19-21,27H,2-3,6-11,13-16H2,1H3,(H,28,30)(H,29,31);1H