2-[3-[[[7-(ethylamino)-6-nitro-quinazolin-2-yl]amino]methyl]phenoxy]ethanol

Systemtic Name: 2-[3-[[[7-(ethylamino)-6-nitro-quinazolin-2-yl]amino]methyl]phenoxy]ethanol Openeye Name: 2-[3-[[[7-(ethylamino)-6-nitro-quinazolin-2-yl]amino]methyl]phenoxy]ethanol CAS Name: 2-[3-[[[7-(ethylamino)-6-nitro-2-quinazolinyl]amino]methyl]phenoxy]ethanol IUPAC Name: 2-[3-[[[7-(ethylamino)-6-nitroquinazolin-2-yl]amino]methyl]phenoxy]ethanol Traditional Name: 2-[3-[[[7-(ethylamino)-6-nitro-quinazolin-2-yl]amino]methyl]phenoxy]ethanol Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C=NC(=NC2=C1)NCC3=CC(=CC=C3)OCCO)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C=NC(=NC2=C1)NCC3=CC(=CC=C3)OCCO)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O4/c1-2-20-17-10-16-14(9-18(17)24(26)27)12-22-19(23-16)21-11-13-4-3-5-15(8-13)28-7-6-25/h3-5,8-10,12,20,25H,2,6-7,11H2,1H3,(H,21,22,23)