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2-[3-cyano-4-(cycloheptylamino)phenyl]pyridine-4-carboxylic acid

2-[3-cyano-4-(cycloheptylamino)phenyl]pyridine-4-carboxylic acid

Systemtic Name:2-[3-cyano-4-(cycloheptylamino)phenyl]pyridine-4-carboxylic acid
Openeye Name:2-[3-cyano-4-(cycloheptylamino)phenyl]pyridine-4-carboxylic acid
CAS Name:2-[3-cyano-4-(cycloheptylamino)phenyl]-4-pyridinecarboxylic acid
IUPAC Name:2-[3-cyano-4-(cycloheptylamino)phenyl]pyridine-4-carboxylic acid
Traditional Name:2-[3-cyano-4-(cycloheptylamino)phenyl]isonicotinic acid
Formula: C20H21N3O2
MolecularWeight: 335.39964
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=C(C=C(C=C2)C3=NC=CC(=C3)C(=O)O)C#N


Isomeric SMILES

C1CCCC(CC1)NC2=C(C=C(C=C2)C3=NC=CC(=C3)C(=O)O)C#N


InChI

InChI=1S/C20H21N3O2/c21-13-16-11-14(19-12-15(20(24)25)9-10-22-19)7-8-18(16)23-17-5-3-1-2-4-6-17/h7-12,17,23H,1-6H2,(H,24,25)


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