tert-butyl 4-[(3-aminophenyl)-[4-(diethylcarbamoyl)phenyl]methylidene]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-aminophenyl)-[4-(diethylcarbamoyl)phenyl]methylidene]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(3-aminophenyl)-[4-(diethylcarbamoyl)phenyl]methylene]piperidine-1-carboxylate CAS Name: 4-[(3-aminophenyl)-[4-[diethylamino(oxo)methyl]phenyl]methylidene]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-aminophenyl)-[4-(diethylcarbamoyl)phenyl]methylidene]piperidine-1-carboxylate Traditional Name: 4-[(3-aminophenyl)-[4-(diethylcarbamoyl)phenyl]methylene]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H37N3O3 MolecularWeight: 463.61168

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)C(=O)OC(C)(C)C)C3=CC(=CC=C3)N

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(=C2CCN(CC2)C(=O)OC(C)(C)C)C3=CC(=CC=C3)N

InChI

InChI=1S/C28H37N3O3/c1-6-30(7-2)26(32)22-13-11-20(12-14-22)25(23-9-8-10-24(29)19-23)21-15-17-31(18-16-21)27(33)34-28(3,4)5/h8-14,19H,6-7,15-18,29H2,1-5H3