2-aminocarbonyl-5-[(3-phenoxyphenyl)methyl-(1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]terephthalic acid

Systemtic Name: 2-aminocarbonyl-5-[(3-phenoxyphenyl)methyl-(1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]terephthalic acid Openeye Name: 2-carbamoyl-5-[(3-phenoxyphenyl)methyl-tetralin-1-yl-carbamoyl]terephthalic acid CAS Name: 2-carbamoyl-5-[oxo-[(3-phenoxyphenyl)methyl-(1,2,3,4-tetrahydronaphthalen-1-yl)amino]methyl]terephthalic acid IUPAC Name: 2-carbamoyl-5-[(3-phenoxyphenyl)methyl-(1,2,3,4-tetrahydronaphthalen-1-yl)carbamoyl]terephthalic acid Traditional Name: 2-carbamoyl-5-[(3-phenoxybenzyl)-tetralin-1-yl-carbamoyl]terephthalic acid Formula: C33H28N2O7 MolecularWeight: 564.58462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)N(CC3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)C5=C(C=C(C(=C5)C(=O)O)C(=O)N)C(=O)O

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)N(CC3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)C5=C(C=C(C(=C5)C(=O)O)C(=O)N)C(=O)O

InChI

InChI=1S/C33H28N2O7/c34-30(36)25-17-28(33(40)41)26(18-27(25)32(38)39)31(37)35(29-15-7-10-21-9-4-5-14-24(21)29)19-20-8-6-13-23(16-20)42-22-11-2-1-3-12-22/h1-6,8-9,11-14,16-18,29H,7,10,15,19H2,(H2,34,36)(H,38,39)(H,40,41)