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

Systemtic Name: methyl N-[4-(azepan-1-ylsulfonyl)phenyl]carbamate Openeye Name: methyl N-[4-(azepan-1-ylsulfonyl)phenyl]carbamate CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-(azepan-1-ylsulfonyl)phenyl]carbamate Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]carbamic acid methyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C14H20N2O4S/c1-20-14(17)15-12-6-8-13(9-7-12)21(18,19)16-10-4-2-3-5-11-16/h6-9H,2-5,10-11H2,1H3,(H,15,17)