tert-butyl 2-azanyl-5-[3-(2-phenylmethoxyphenyl)propyl]benzoate

Systemtic Name: tert-butyl 2-azanyl-5-[3-(2-phenylmethoxyphenyl)propyl]benzoate Openeye Name: tert-butyl 2-amino-5-[3-(2-benzyloxyphenyl)propyl]benzoate CAS Name: 2-amino-5-[3-(2-phenylmethoxyphenyl)propyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-5-[3-(2-phenylmethoxyphenyl)propyl]benzoate Traditional Name: 2-amino-5-[3-(2-benzoxyphenyl)propyl]benzoic acid tert-butyl ester Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)CCCC2=CC=CC=C2OCC3=CC=CC=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)CCCC2=CC=CC=C2OCC3=CC=CC=C3)N

InChI

InChI=1S/C27H31NO3/c1-27(2,3)31-26(29)23-18-20(16-17-24(23)28)12-9-14-22-13-7-8-15-25(22)30-19-21-10-5-4-6-11-21/h4-8,10-11,13,15-18H,9,12,14,19,28H2,1-3H3