[4-[[3-aminocarbonyl-4-(4-methylhexoxy)phenyl]methylcarbamoyl]phenyl] dihydrogen phosphate

Systemtic Name: [4-[[3-aminocarbonyl-4-(4-methylhexoxy)phenyl]methylcarbamoyl]phenyl] dihydrogen phosphate Openeye Name: [4-[[3-carbamoyl-4-(4-methylhexoxy)phenyl]methylcarbamoyl]phenyl] dihydrogen phosphate CAS Name: [4-[[[3-carbamoyl-4-(4-methylhexoxy)phenyl]methylamino]-oxomethyl]phenyl] dihydrogen phosphate IUPAC Name: [4-[[3-carbamoyl-4-(4-methylhexoxy)phenyl]methylcarbamoyl]phenyl] dihydrogen phosphate Traditional Name: [4-[[3-carbamoyl-4-(4-methylhexoxy)benzyl]carbamoyl]phenyl] dihydrogen phosphate Formula: C22H29N2O7P MolecularWeight: 464.448621

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)OP(=O)(O)O)C(=O)N

Isomeric SMILES

CCC(C)CCCOC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)OP(=O)(O)O)C(=O)N

InChI

InChI=1S/C22H29N2O7P/c1-3-15(2)5-4-12-30-20-11-6-16(13-19(20)21(23)25)14-24-22(26)17-7-9-18(10-8-17)31-32(27,28)29/h6-11,13,15H,3-5,12,14H2,1-2H3,(H2,23,25)(H,24,26)(H2,27,28,29)