7-[4-(2-azanylethyl)phenyl]-7-pyridin-3-yl-heptanoic acid

Systemtic Name: 7-[4-(2-azanylethyl)phenyl]-7-pyridin-3-yl-heptanoic acid Openeye Name: 7-[4-(2-aminoethyl)phenyl]-7-(3-pyridyl)heptanoic acid CAS Name: 7-[4-(2-aminoethyl)phenyl]-7-(3-pyridinyl)heptanoic acid IUPAC Name: 7-[4-(2-aminoethyl)phenyl]-7-pyridin-3-ylheptanoic acid Traditional Name: 7-[4-(2-aminoethyl)phenyl]-7-(3-pyridyl)enanthic acid Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CCCCCC(=O)O)C2=CC=C(C=C2)CCN

Isomeric SMILES

C1=CC(=CN=C1)C(CCCCCC(=O)O)C2=CC=C(C=C2)CCN

InChI

InChI=1S/C20H26N2O2/c21-13-12-16-8-10-17(11-9-16)19(18-5-4-14-22-15-18)6-2-1-3-7-20(23)24/h4-5,8-11,14-15,19H,1-3,6-7,12-13,21H2,(H,23,24)