tert-butyl 4-(2-azanyl-6-phenylmethoxy-phenyl)carbonyl-3,5-bis(phenylmethoxy)benzoate

Systemtic Name: tert-butyl 4-(2-azanyl-6-phenylmethoxy-phenyl)carbonyl-3,5-bis(phenylmethoxy)benzoate Openeye Name: tert-butyl 4-(2-amino-6-benzyloxy-benzoyl)-3,5-dibenzyloxy-benzoate CAS Name: 4-[(2-amino-6-phenylmethoxyphenyl)-oxomethyl]-3,5-bis(phenylmethoxy)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-amino-6-phenylmethoxybenzoyl)-3,5-bis(phenylmethoxy)benzoate Traditional Name: 4-(2-amino-6-benzoxy-benzoyl)-3,5-dibenzoxy-benzoic acid tert-butyl ester Formula: C39H37NO6 MolecularWeight: 615.71418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)N)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)N)OCC5=CC=CC=C5

InChI

InChI=1S/C39H37NO6/c1-39(2,3)46-38(42)30-22-33(44-25-28-16-9-5-10-17-28)36(34(23-30)45-26-29-18-11-6-12-19-29)37(41)35-31(40)20-13-21-32(35)43-24-27-14-7-4-8-15-27/h4-23H,24-26,40H2,1-3H3