2-[(4-tert-butylphenyl)carbonyl-(naphthalen-1-ylmethyl)amino]-3-(4-phenylphenyl)propanoic acid

Systemtic Name: 2-[(4-tert-butylphenyl)carbonyl-(naphthalen-1-ylmethyl)amino]-3-(4-phenylphenyl)propanoic acid Openeye Name: 2-[(4-tert-butylbenzoyl)-(1-naphthylmethyl)amino]-3-(4-phenylphenyl)propanoic acid CAS Name: 2-[[(4-tert-butylphenyl)-oxomethyl]-(1-naphthalenylmethyl)amino]-3-(4-phenylphenyl)propanoic acid IUPAC Name: 2-[(4-tert-butylbenzoyl)-(naphthalen-1-ylmethyl)amino]-3-(4-phenylphenyl)propanoic acid Traditional Name: 2-[(4-tert-butylbenzoyl)-(1-naphthylmethyl)amino]-3-(4-phenylphenyl)propionic acid Formula: C37H35NO3 MolecularWeight: 541.6787

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2=CC=CC3=CC=CC=C32)C(CC4=CC=C(C=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2=CC=CC3=CC=CC=C32)C(CC4=CC=C(C=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C37H35NO3/c1-37(2,3)32-22-20-30(21-23-32)35(39)38(25-31-14-9-13-29-12-7-8-15-33(29)31)34(36(40)41)24-26-16-18-28(19-17-26)27-10-5-4-6-11-27/h4-23,34H,24-25H2,1-3H3,(H,40,41)