1-(6-heptoxynaphthalen-2-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(6-heptoxynaphthalen-2-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(6-heptoxynaphthalene-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(6-heptoxy-2-naphthalenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(6-heptoxynaphthalene-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(6-heptoxy-2-naphthoyl)isonipecotic acid Formula: C24H31NO4 MolecularWeight: 397.50724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

CCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C24H31NO4/c1-2-3-4-5-6-15-29-22-10-9-19-16-21(8-7-20(19)17-22)23(26)25-13-11-18(12-14-25)24(27)28/h7-10,16-18H,2-6,11-15H2,1H3,(H,27,28)