4-[3-(5-chloranylpentanoylamino)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-[3-(5-chloranylpentanoylamino)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-[3-(5-chloropentanoylamino)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-[3-[(5-chloro-1-oxopentyl)amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-[3-(5-chloropentanoylamino)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-[3-(5-chloropentanoylamino)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C20H23ClN2O5 MolecularWeight: 406.86002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)NC(=O)CCCCCl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)NC(=O)CCCCCl)C(=O)O

InChI

InChI=1S/C20H23ClN2O5/c1-11-16(19(25)26)18(17(20(27)28)12(2)22-11)13-6-5-7-14(10-13)23-15(24)8-3-4-9-21/h5-7,10,18,22H,3-4,8-9H2,1-2H3,(H,23,24)(H,25,26)(H,27,28)