[2-[4-azanyl-7-ethyl-5-fluoranyl-1-(2-methylpropyl)indol-2-yl]furan-3-yl]phosphonic acid

Systemtic Name: [2-[4-azanyl-7-ethyl-5-fluoranyl-1-(2-methylpropyl)indol-2-yl]furan-3-yl]phosphonic acid Openeye Name: [2-(4-amino-7-ethyl-5-fluoro-1-isobutyl-indol-2-yl)-3-furyl]phosphonic acid CAS Name: [2-[4-amino-7-ethyl-5-fluoro-1-(2-methylpropyl)-2-indolyl]-3-furanyl]phosphonic acid IUPAC Name: [2-[4-amino-7-ethyl-5-fluoro-1-(2-methylpropyl)indol-2-yl]furan-3-yl]phosphonic acid Traditional Name: [2-(4-amino-7-ethyl-5-fluoro-1-isobutyl-indol-2-yl)-3-furyl]phosphonic acid Formula: C18H22FN2O4P MolecularWeight: 380.350444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C2=C1N(C(=C2)C3=C(C=CO3)P(=O)(O)O)CC(C)C)N)F

Isomeric SMILES

CCC1=CC(=C(C2=C1N(C(=C2)C3=C(C=CO3)P(=O)(O)O)CC(C)C)N)F

InChI

InChI=1S/C18H22FN2O4P/c1-4-11-7-13(19)16(20)12-8-14(21(17(11)12)9-10(2)3)18-15(5-6-25-18)26(22,23)24/h5-8,10H,4,9,20H2,1-3H3,(H2,22,23,24)