(phenylmethyl) N-[1-[2-chloranyl-4-(pyridin-4-ylcarbamoyl)phenyl]ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[2-chloranyl-4-(pyridin-4-ylcarbamoyl)phenyl]ethyl]carbamate Openeye Name: benzyl N-[1-[2-chloro-4-(4-pyridylcarbamoyl)phenyl]ethyl]carbamate CAS Name: N-[1-[2-chloro-4-[oxo-(pyridin-4-ylamino)methyl]phenyl]ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-chloro-4-(pyridin-4-ylcarbamoyl)phenyl]ethyl]carbamate Traditional Name: N-[1-[2-chloro-4-(4-pyridylcarbamoyl)phenyl]ethyl]carbamic acid benzyl ester Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)NC2=CC=NC=C2)Cl)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)NC2=CC=NC=C2)Cl)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20ClN3O3/c1-15(25-22(28)29-14-16-5-3-2-4-6-16)19-8-7-17(13-20(19)23)21(27)26-18-9-11-24-12-10-18/h2-13,15H,14H2,1H3,(H,25,28)(H,24,26,27)