(phenylmethyl) N-[(6-butyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-N-propan-2-yl-carbamate

Systemtic Name: (phenylmethyl) N-[(6-butyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-N-propan-2-yl-carbamate Openeye Name: benzyl N-[(6-butyl-2-oxo-1H-pyridin-3-yl)methyl]-N-isopropyl-carbamate CAS Name: N-[(6-butyl-2-oxo-1H-pyridin-3-yl)methyl]-N-propan-2-ylcarbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(6-butyl-2-oxo-1H-pyridin-3-yl)methyl]-N-propan-2-ylcarbamate Traditional Name: N-[(6-butyl-2-keto-1H-pyridin-3-yl)methyl]-N-isopropyl-carbamic acid benzyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1)CN(C(C)C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1)CN(C(C)C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O3/c1-4-5-11-19-13-12-18(20(24)22-19)14-23(16(2)3)21(25)26-15-17-9-7-6-8-10-17/h6-10,12-13,16H,4-5,11,14-15H2,1-3H3,(H,22,24)