3-[[2-[[[7-(ethylamino)-6-nitro-quinazolin-4-yl]amino]methyl]phenyl]amino]propan-1-ol

Systemtic Name: 3-[[2-[[[7-(ethylamino)-6-nitro-quinazolin-4-yl]amino]methyl]phenyl]amino]propan-1-ol Openeye Name: 3-[2-[[[7-(ethylamino)-6-nitro-quinazolin-4-yl]amino]methyl]anilino]propan-1-ol CAS Name: 3-[2-[[[7-(ethylamino)-6-nitro-4-quinazolinyl]amino]methyl]anilino]-1-propanol IUPAC Name: 3-[2-[[[7-(ethylamino)-6-nitroquinazolin-4-yl]amino]methyl]anilino]propan-1-ol Traditional Name: 3-[2-[[[7-(ethylamino)-6-nitro-quinazolin-4-yl]amino]methyl]anilino]propan-1-ol Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3NCCCO)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=CN=C2NCC3=CC=CC=C3NCCCO)[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O3/c1-2-21-18-11-17-15(10-19(18)26(28)29)20(25-13-24-17)23-12-14-6-3-4-7-16(14)22-8-5-9-27/h3-4,6-7,10-11,13,21-22,27H,2,5,8-9,12H2,1H3,(H,23,24,25)