3-azanyl-7-[3,3-bis(hydroxymethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-quinazoline-2,4-dione

Systemtic Name: 3-azanyl-7-[3,3-bis(hydroxymethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-quinazoline-2,4-dione Openeye Name: 3-amino-7-[3,3-bis(hydroxymethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-quinazoline-2,4-dione CAS Name: 3-amino-7-[3,3-bis(hydroxymethyl)-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxyquinazoline-2,4-dione IUPAC Name: 3-amino-7-[3,3-bis(hydroxymethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxyquinazoline-2,4-dione Traditional Name: 3-amino-1-cyclopropyl-7-(3,3-dimethylolpyrrolidino)-6-fluoro-8-methoxy-quinazoline-2,4-quinone Formula: C18H23FN4O5 MolecularWeight: 394.397423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(C3)(CO)CO)F)C(=O)N(C(=O)N2C4CC4)N

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(C3)(CO)CO)F)C(=O)N(C(=O)N2C4CC4)N

InChI

InChI=1S/C18H23FN4O5/c1-28-15-13-11(16(26)23(20)17(27)22(13)10-2-3-10)6-12(19)14(15)21-5-4-18(7-21,8-24)9-25/h6,10,24-25H,2-5,7-9,20H2,1H3