2-[6-(2-azanylethanoylamino)naphthalen-2-yl]-2-[4-(cyclopentylmethoxy)phenyl]propanoic acid

Systemtic Name: 2-[6-(2-azanylethanoylamino)naphthalen-2-yl]-2-[4-(cyclopentylmethoxy)phenyl]propanoic acid Openeye Name: 2-[6-[(2-aminoacetyl)amino]-2-naphthyl]-2-[4-(cyclopentylmethoxy)phenyl]propanoic acid CAS Name: 2-[6-[(2-amino-1-oxoethyl)amino]-2-naphthalenyl]-2-[4-(cyclopentylmethoxy)phenyl]propanoic acid IUPAC Name: 2-[6-[(2-aminoacetyl)amino]naphthalen-2-yl]-2-[4-(cyclopentylmethoxy)phenyl]propanoic acid Traditional Name: 2-[4-(cyclopentylmethoxy)phenyl]-2-[6-(glycylamino)-2-naphthyl]propionic acid Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OCC2CCCC2)(C3=CC4=C(C=C3)C=C(C=C4)NC(=O)CN)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)OCC2CCCC2)(C3=CC4=C(C=C3)C=C(C=C4)NC(=O)CN)C(=O)O

InChI

InChI=1S/C27H30N2O4/c1-27(26(31)32,21-9-12-24(13-10-21)33-17-18-4-2-3-5-18)22-8-6-20-15-23(29-25(30)16-28)11-7-19(20)14-22/h6-15,18H,2-5,16-17,28H2,1H3,(H,29,30)(H,31,32)