(phenylmethyl) N-[4-(azepan-1-ylsulfonyl)phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[4-(azepan-1-ylsulfonyl)phenyl]carbamate Openeye Name: benzyl N-[4-(azepan-1-ylsulfonyl)phenyl]carbamate CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-(azepan-1-ylsulfonyl)phenyl]carbamate Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]carbamic acid benzyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O4S/c23-20(26-16-17-8-4-3-5-9-17)21-18-10-12-19(13-11-18)27(24,25)22-14-6-1-2-7-15-22/h3-5,8-13H,1-2,6-7,14-16H2,(H,21,23)