[3-azanyl-3-methyl-5-[2-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]pentyl]phosphonic acid

Systemtic Name: [3-azanyl-3-methyl-5-[2-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]pentyl]phosphonic acid Openeye Name: [3-amino-3-methyl-5-[2-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]pentyl]phosphonic acid CAS Name: [3-amino-3-methyl-5-[2-methyl-5-(1-oxo-5-phenylpentyl)-2-pyrrolyl]pentyl]phosphonic acid IUPAC Name: [3-amino-3-methyl-5-[2-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]pentyl]phosphonic acid Traditional Name: [3-amino-3-methyl-5-[2-methyl-5-(5-phenylpentanoyl)pyrrol-2-yl]pentyl]phosphonic acid Formula: C22H33N2O4P MolecularWeight: 420.482181

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=N1)C(=O)CCCCC2=CC=CC=C2)CCC(C)(CCP(=O)(O)O)N

Isomeric SMILES

CC1(C=CC(=N1)C(=O)CCCCC2=CC=CC=C2)CCC(C)(CCP(=O)(O)O)N

InChI

InChI=1S/C22H33N2O4P/c1-21(23,16-17-29(26,27)28)14-15-22(2)13-12-19(24-22)20(25)11-7-6-10-18-8-4-3-5-9-18/h3-5,8-9,12-13H,6-7,10-11,14-17,23H2,1-2H3,(H2,26,27,28)