tert-butyl 4-[4-methyl-3-(2-methylpropanoylamino)phenyl]-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-methyl-3-(2-methylpropanoylamino)phenyl]-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 4-[4-methyl-3-(2-methylpropanoylamino)phenyl]-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 4-[4-methyl-3-[(2-methyl-1-oxopropyl)amino]phenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-methyl-3-(2-methylpropanoylamino)phenyl]-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 4-[3-(isobutyrylamino)-4-methyl-phenyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CCN(CC2)C(=O)OC(C)(C)C)NC(=O)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CCN(CC2)C(=O)OC(C)(C)C)NC(=O)C(C)C

InChI

InChI=1S/C21H30N2O3/c1-14(2)19(24)22-18-13-17(8-7-15(18)3)16-9-11-23(12-10-16)20(25)26-21(4,5)6/h7-9,13-14H,10-12H2,1-6H3,(H,22,24)