[2-azanyl-2-methyl-4-[1-methyl-5-[3-(4-methylphenoxy)prop-1-ynyl]pyrrol-2-yl]butyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-2-methyl-4-[1-methyl-5-[3-(4-methylphenoxy)prop-1-ynyl]pyrrol-2-yl]butyl] dihydrogen phosphate Openeye Name: [2-amino-2-methyl-4-[1-methyl-5-[3-(4-methylphenoxy)prop-1-ynyl]pyrrol-2-yl]butyl] dihydrogen phosphate CAS Name: [2-amino-2-methyl-4-[1-methyl-5-[3-(4-methylphenoxy)prop-1-ynyl]-2-pyrrolyl]butyl] dihydrogen phosphate IUPAC Name: [2-amino-2-methyl-4-[1-methyl-5-[3-(4-methylphenoxy)prop-1-ynyl]pyrrol-2-yl]butyl] dihydrogen phosphate Traditional Name: [2-amino-2-methyl-4-[1-methyl-5-[3-(4-methylphenoxy)prop-1-ynyl]pyrrol-2-yl]butyl] dihydrogen phosphate Formula: C20H27N2O5P MolecularWeight: 406.412541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC#CC2=CC=C(N2C)CCC(C)(COP(=O)(O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)OCC#CC2=CC=C(N2C)CCC(C)(COP(=O)(O)O)N

InChI

InChI=1S/C20H27N2O5P/c1-16-6-10-19(11-7-16)26-14-4-5-17-8-9-18(22(17)3)12-13-20(2,21)15-27-28(23,24)25/h6-11H,12-15,21H2,1-3H3,(H2,23,24,25)