[3-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamoyl]-4-oxidanyl-naphthalen-1-yl] N-naphthalen-1-ylcarbamate

Systemtic Name: [3-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamoyl]-4-oxidanyl-naphthalen-1-yl] N-naphthalen-1-ylcarbamate Openeye Name: [3-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butylcarbamoyl]-4-hydroxy-1-naphthyl] N-(1-naphthyl)carbamate CAS Name: N-(1-naphthalenyl)carbamic acid [3-[[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylamino]-oxomethyl]-4-hydroxy-1-naphthalenyl] ester IUPAC Name: [3-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butylcarbamoyl]-4-hydroxynaphthalen-1-yl] N-naphthalen-1-ylcarbamate Traditional Name: N-(1-naphthyl)carbamic acid [3-[4-(2,4-ditert-amylphenoxy)butylcarbamoyl]-4-hydroxy-1-naphthyl] ester Formula: C42H48N2O5 MolecularWeight: 660.84092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)OC(=O)NC4=CC=CC5=CC=CC=C54)O)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)OC(=O)NC4=CC=CC5=CC=CC=C54)O)C(C)(C)CC

InChI

InChI=1S/C42H48N2O5/c1-7-41(3,4)29-22-23-36(34(26-29)42(5,6)8-2)48-25-14-13-24-43-39(46)33-27-37(31-19-11-12-20-32(31)38(33)45)49-40(47)44-35-21-15-17-28-16-9-10-18-30(28)35/h9-12,15-23,26-27,45H,7-8,13-14,24-25H2,1-6H3,(H,43,46)(H,44,47)