2-methylpropyl N-[8-(2-dimethylaminoethylsulfanyl)-6-(3-dodecoxypropylcarbamoyl)-5-oxidanyl-naphthalen-1-yl]carbamate

Systemtic Name: 2-methylpropyl N-[8-(2-dimethylaminoethylsulfanyl)-6-(3-dodecoxypropylcarbamoyl)-5-oxidanyl-naphthalen-1-yl]carbamate Openeye Name: isobutyl N-[8-(2-dimethylaminoethylsulfanyl)-6-(3-dodecoxypropylcarbamoyl)-5-hydroxy-1-naphthyl]carbamate CAS Name: N-[8-(2-dimethylaminoethylthio)-6-[(3-dodecoxypropylamino)-oxomethyl]-5-hydroxy-1-naphthalenyl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[8-(2-dimethylaminoethylsulfanyl)-6-(3-dodecoxypropylcarbamoyl)-5-hydroxynaphthalen-1-yl]carbamate Traditional Name: N-[8-(2-dimethylaminoethylthio)-5-hydroxy-6-(3-lauryloxypropylcarbamoyl)-1-naphthyl]carbamic acid isobutyl ester Formula: C35H57N3O5S MolecularWeight: 631.90918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCCCNC(=O)C1=CC(=C2C(=C1O)C=CC=C2NC(=O)OCC(C)C)SCCN(C)C

Isomeric SMILES

CCCCCCCCCCCCOCCCNC(=O)C1=CC(=C2C(=C1O)C=CC=C2NC(=O)OCC(C)C)SCCN(C)C

InChI

InChI=1S/C35H57N3O5S/c1-6-7-8-9-10-11-12-13-14-15-22-42-23-17-20-36-34(40)29-25-31(44-24-21-38(4)5)32-28(33(29)39)18-16-19-30(32)37-35(41)43-26-27(2)3/h16,18-19,25,27,39H,6-15,17,20-24,26H2,1-5H3,(H,36,40)(H,37,41)