7-(3-azanylpropyl)adamantane-1,3,5-tricarboxylic acid hydrochloride

Systemtic Name: 7-(3-azanylpropyl)adamantane-1,3,5-tricarboxylic acid hydrochloride Openeye Name: 7-(3-aminopropyl)adamantane-1,3,5-tricarboxylic acid hydrochloride CAS Name: 7-(3-aminopropyl)adamantane-1,3,5-tricarboxylic acid hydrochloride IUPAC Name: 7-(3-aminopropyl)adamantane-1,3,5-tricarboxylic acid hydrochloride Traditional Name: 7-(3-aminopropyl)adamantane-1,3,5-tricarboxylic acid hydrochloride Formula: C16H24ClNO6 MolecularWeight: 361.81786

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Descriptors Computed from Structure

Canonical SMILES:

C1C2(CC3(CC1(CC(C2)(C3)C(=O)O)C(=O)O)C(=O)O)CCCN.Cl

Isomeric SMILES

C1C2(CC3(CC1(CC(C2)(C3)C(=O)O)C(=O)O)C(=O)O)CCCN.Cl

InChI

InChI=1S/C16H23NO6.ClH/c17-3-1-2-13-4-14(10(18)19)7-15(5-13,11(20)21)9-16(6-13,8-14)12(22)23;/h1-9,17H2,(H,18,19)(H,20,21)(H,22,23);1H