tert-butyl 4-[[3-[2-azanyl-4-(methylcarbamoyl)phenyl]phenyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-[2-azanyl-4-(methylcarbamoyl)phenyl]phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-[2-amino-4-(methylcarbamoyl)phenyl]phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[3-[2-amino-4-(methylcarbamoyl)phenyl]anilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-[2-amino-4-(methylcarbamoyl)phenyl]phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[3-[2-amino-4-(methylcarbamoyl)phenyl]phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H32N4O4 MolecularWeight: 452.54598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3=C(C=C(C=C3)C(=O)NC)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)C3=C(C=C(C=C3)C(=O)NC)N

InChI

InChI=1S/C25H32N4O4/c1-25(2,3)33-24(32)29-12-10-16(11-13-29)23(31)28-19-7-5-6-17(14-19)20-9-8-18(15-21(20)26)22(30)27-4/h5-9,14-16H,10-13,26H2,1-4H3,(H,27,30)(H,28,31)