tert-butyl 1-[[2-[(4-phenylphenyl)methylamino]phenyl]amino]-1,3-dihydroisoindole-2-carboxylate

Systemtic Name: tert-butyl 1-[[2-[(4-phenylphenyl)methylamino]phenyl]amino]-1,3-dihydroisoindole-2-carboxylate Openeye Name: tert-butyl 1-[2-[(4-phenylphenyl)methylamino]anilino]isoindoline-2-carboxylate CAS Name: 1-[2-[(4-phenylphenyl)methylamino]anilino]-1,3-dihydroisoindole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[2-[(4-phenylphenyl)methylamino]anilino]-1,3-dihydroisoindole-2-carboxylate Traditional Name: 1-[2-[(4-phenylbenzyl)amino]anilino]isoindoline-2-carboxylic acid tert-butyl ester Formula: C32H33N3O2 MolecularWeight: 491.62332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2=CC=CC=C2C1NC3=CC=CC=C3NCC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2=CC=CC=C2C1NC3=CC=CC=C3NCC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H33N3O2/c1-32(2,3)37-31(36)35-22-26-13-7-8-14-27(26)30(35)34-29-16-10-9-15-28(29)33-21-23-17-19-25(20-18-23)24-11-5-4-6-12-24/h4-20,30,33-34H,21-22H2,1-3H3