chloranylbenzene; N-[4-(4-sulfanylphenoxy)butan-2-yl]carbamate

Systemtic Name: chloranylbenzene; N-[4-(4-sulfanylphenoxy)butan-2-yl]carbamate Openeye Name: chlorobenzene; N-[1-methyl-3-(4-sulfanylphenoxy)propyl]carbamate CAS Name: chlorobenzene; N-[4-(4-mercaptophenoxy)butan-2-yl]carbamate IUPAC Name: chlorobenzene; N-[4-(4-sulfanylphenoxy)butan-2-yl]carbamate Traditional Name: chlorobenzene; N-[3-(4-mercaptophenoxy)-1-methyl-propyl]carbamate Formula: C17H19ClNO3S- MolecularWeight: 352.85566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=CC=C(C=C1)S)NC(=O)[O-].C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(CCOC1=CC=C(C=C1)S)NC(=O)[O-].C1=CC=C(C=C1)Cl

InChI

InChI=1S/C11H15NO3S.C6H5Cl/c1-8(12-11(13)14)6-7-15-9-2-4-10(16)5-3-9;7-6-4-2-1-3-5-6/h2-5,8,12,16H,6-7H2,1H3,(H,13,14);1-5H/p-1