methyl 6-[[2-(4-aminophenyl)-3-cyclopentyl-propanoyl]amino]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[2-(4-aminophenyl)-3-cyclopentyl-propanoyl]amino]pyridine-3-carboxylate Openeye Name: methyl 6-[[2-(4-aminophenyl)-3-cyclopentyl-propanoyl]amino]pyridine-3-carboxylate CAS Name: 6-[[2-(4-aminophenyl)-3-cyclopentyl-1-oxopropyl]amino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[2-(4-aminophenyl)-3-cyclopentylpropanoyl]amino]pyridine-3-carboxylate Traditional Name: 6-[[2-(4-aminophenyl)-3-cyclopentyl-propanoyl]amino]nicotinic acid methyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)NC(=O)C(CC2CCCC2)C3=CC=C(C=C3)N

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)NC(=O)C(CC2CCCC2)C3=CC=C(C=C3)N

InChI

InChI=1S/C21H25N3O3/c1-27-21(26)16-8-11-19(23-13-16)24-20(25)18(12-14-4-2-3-5-14)15-6-9-17(22)10-7-15/h6-11,13-14,18H,2-5,12,22H2,1H3,(H,23,24,25)