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

Systemtic Name: 7-[3-(aminomethyl)-3-oxidanyl-pyrrolidin-1-yl]-3-azanyl-1-cyclopropyl-6-fluoranyl-8-methoxy-quinazoline-2,4-dione hydrochloride Openeye Name: 3-amino-7-[3-(aminomethyl)-3-hydroxy-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-quinazoline-2,4-dione hydrochloride CAS Name: 3-amino-7-[3-(aminomethyl)-3-hydroxy-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxyquinazoline-2,4-dione hydrochloride IUPAC Name: 3-amino-7-[3-(aminomethyl)-3-hydroxypyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxyquinazoline-2,4-dione hydrochloride Traditional Name: 3-amino-7-[3-(aminomethyl)-3-hydroxy-pyrrolidino]-1-cyclopropyl-6-fluoro-8-methoxy-quinazoline-2,4-quinone hydrochloride Formula: C17H23ClFN5O4 MolecularWeight: 415.847023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(C3)(CN)O)F)C(=O)N(C(=O)N2C4CC4)N.Cl

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(C3)(CN)O)F)C(=O)N(C(=O)N2C4CC4)N.Cl

InChI

InChI=1S/C17H22FN5O4.ClH/c1-27-14-12-10(15(24)23(20)16(25)22(12)9-2-3-9)6-11(18)13(14)21-5-4-17(26,7-19)8-21;/h6,9,26H,2-5,7-8,19-20H2,1H3;1H