tert-butyl 4-[bromanyl-[4-[di(propan-2-yl)carbamoyl]phenyl]methylidene]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[bromanyl-[4-[di(propan-2-yl)carbamoyl]phenyl]methylidene]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[bromo-[4-(diisopropylcarbamoyl)phenyl]methylene]piperidine-1-carboxylate CAS Name: 4-[bromo-[4-[[di(propan-2-yl)amino]-oxomethyl]phenyl]methylidene]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[bromo-[4-[di(propan-2-yl)carbamoyl]phenyl]methylidene]piperidine-1-carboxylate Traditional Name: 4-[bromo-[4-(diisopropylcarbamoyl)phenyl]methylene]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H35BrN2O3 MolecularWeight: 479.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)C(=O)OC(C)(C)C)Br

Isomeric SMILES

CC(C)N(C(C)C)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)C(=O)OC(C)(C)C)Br

InChI

InChI=1S/C24H35BrN2O3/c1-16(2)27(17(3)4)22(28)20-10-8-18(9-11-20)21(25)19-12-14-26(15-13-19)23(29)30-24(5,6)7/h8-11,16-17H,12-15H2,1-7H3