3-(dimethylamino)propyl 2-heptadecyl-3H-benzimidazole-5-carboxylate hydrochloride

Systemtic Name: 3-(dimethylamino)propyl 2-heptadecyl-3H-benzimidazole-5-carboxylate hydrochloride Openeye Name: 3-(dimethylamino)propyl 2-heptadecyl-3H-benzimidazole-5-carboxylate hydrochloride CAS Name: 2-heptadecyl-3H-benzimidazole-5-carboxylic acid 3-(dimethylamino)propyl ester hydrochloride IUPAC Name: 3-(dimethylamino)propyl 2-heptadecyl-3H-benzimidazole-5-carboxylate hydrochloride Traditional Name: 2-heptadecyl-3H-benzimidazole-5-carboxylic acid 3-(dimethylamino)propyl ester hydrochloride Formula: C30H52ClN3O2 MolecularWeight: 522.20578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NC2=C(N1)C=C(C=C2)C(=O)OCCCN(C)C.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NC2=C(N1)C=C(C=C2)C(=O)OCCCN(C)C.Cl

InChI

InChI=1S/C30H51N3O2.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-29-31-27-22-21-26(25-28(27)32-29)30(34)35-24-19-23-33(2)3;/h21-22,25H,4-20,23-24H2,1-3H3,(H,31,32);1H