tert-butyl 4-[[3-azanyl-4-(methylamino)phenyl]carbonyl-phenyl-amino]butanoate

Systemtic Name: tert-butyl 4-[[3-azanyl-4-(methylamino)phenyl]carbonyl-phenyl-amino]butanoate Openeye Name: tert-butyl 4-(N-[3-amino-4-(methylamino)benzoyl]anilino)butanoate CAS Name: 4-(N-[[3-amino-4-(methylamino)phenyl]-oxomethyl]anilino)butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(N-[3-amino-4-(methylamino)benzoyl]anilino)butanoate Traditional Name: 4-(N-[3-amino-4-(methylamino)benzoyl]anilino)butyric acid tert-butyl ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCCN(C1=CC=CC=C1)C(=O)C2=CC(=C(C=C2)NC)N

Isomeric SMILES

CC(C)(C)OC(=O)CCCN(C1=CC=CC=C1)C(=O)C2=CC(=C(C=C2)NC)N

InChI

InChI=1S/C22H29N3O3/c1-22(2,3)28-20(26)11-8-14-25(17-9-6-5-7-10-17)21(27)16-12-13-19(24-4)18(23)15-16/h5-7,9-10,12-13,15,24H,8,11,14,23H2,1-4H3