2-[4-(8-naphthalen-1-yloctylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(8-naphthalen-1-yloctylamino)phenyl]ethanoic acid Openeye Name: 2-[4-[8-(1-naphthyl)octylamino]phenyl]acetic acid CAS Name: 2-[4-[8-(1-naphthalenyl)octylamino]phenyl]acetic acid IUPAC Name: 2-[4-(8-naphthalen-1-yloctylamino)phenyl]acetic acid Traditional Name: 2-[4-[8-(1-naphthyl)octylamino]phenyl]acetic acid Formula: C26H31NO2 MolecularWeight: 389.52984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CCCCCCCCNC3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CCCCCCCCNC3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C26H31NO2/c28-26(29)20-21-15-17-24(18-16-21)27-19-8-4-2-1-3-5-10-22-12-9-13-23-11-6-7-14-25(22)23/h6-7,9,11-18,27H,1-5,8,10,19-20H2,(H,28,29)