methyl 6-[2-[3-(1H-benzimidazol-2-yl)propanoyl]pyrazolidin-1-yl]carbonylpyridine-3-carboxylate

Systemtic Name: methyl 6-[2-[3-(1H-benzimidazol-2-yl)propanoyl]pyrazolidin-1-yl]carbonylpyridine-3-carboxylate Openeye Name: methyl 6-[2-[3-(1H-benzimidazol-2-yl)propanoyl]pyrazolidine-1-carbonyl]pyridine-3-carboxylate CAS Name: 6-[[2-[3-(1H-benzimidazol-2-yl)-1-oxopropyl]-1-pyrazolidinyl]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-[3-(1H-benzimidazol-2-yl)propanoyl]pyrazolidine-1-carbonyl]pyridine-3-carboxylate Traditional Name: 6-[2-[3-(1H-benzimidazol-2-yl)propanoyl]pyrazolidine-1-carbonyl]nicotinic acid methyl ester Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C(=O)N2CCCN2C(=O)CCC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C(=O)N2CCCN2C(=O)CCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H21N5O4/c1-30-21(29)14-7-8-17(22-13-14)20(28)26-12-4-11-25(26)19(27)10-9-18-23-15-5-2-3-6-16(15)24-18/h2-3,5-8,13H,4,9-12H2,1H3,(H,23,24)