5-(2-imidazol-1-yl-3-methyl-indol-1-yl)pentanoic acid hydrochloride

Systemtic Name: 5-(2-imidazol-1-yl-3-methyl-indol-1-yl)pentanoic acid hydrochloride Openeye Name: 5-(2-imidazol-1-yl-3-methyl-indol-1-yl)pentanoic acid hydrochloride CAS Name: 5-[2-(1-imidazolyl)-3-methyl-1-indolyl]pentanoic acid hydrochloride IUPAC Name: 5-(2-imidazol-1-yl-3-methylindol-1-yl)pentanoic acid hydrochloride Traditional Name: 5-(2-imidazol-1-yl-3-methyl-indol-1-yl)valeric acid hydrochloride Formula: C17H20ClN3O2 MolecularWeight: 333.8126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)CCCCC(=O)O)N3C=CN=C3.Cl

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)CCCCC(=O)O)N3C=CN=C3.Cl

InChI

InChI=1S/C17H19N3O2.ClH/c1-13-14-6-2-3-7-15(14)20(10-5-4-8-16(21)22)17(13)19-11-9-18-12-19;/h2-3,6-7,9,11-12H,4-5,8,10H2,1H3,(H,21,22);1H