6-nitro-7-[2-(oxan-2-yloxy)ethoxy]-N-(1-phenylethyl)quinazolin-4-amine

Systemtic Name: 6-nitro-7-[2-(oxan-2-yloxy)ethoxy]-N-(1-phenylethyl)quinazolin-4-amine Openeye Name: 6-nitro-N-(1-phenylethyl)-7-(2-tetrahydropyran-2-yloxyethoxy)quinazolin-4-amine CAS Name: 6-nitro-7-[2-(2-oxanyloxy)ethoxy]-N-(1-phenylethyl)-4-quinazolinamine IUPAC Name: 6-nitro-7-[2-(oxan-2-yloxy)ethoxy]-N-(1-phenylethyl)quinazolin-4-amine Traditional Name: [6-nitro-7-(2-tetrahydropyran-2-yloxyethoxy)quinazolin-4-yl]-(1-phenylethyl)amine Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OCCOC4CCCCO4

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC3=CC(=C(C=C32)[N+](=O)[O-])OCCOC4CCCCO4

InChI

InChI=1S/C23H26N4O5/c1-16(17-7-3-2-4-8-17)26-23-18-13-20(27(28)29)21(14-19(18)24-15-25-23)30-11-12-32-22-9-5-6-10-31-22/h2-4,7-8,13-16,22H,5-6,9-12H2,1H3,(H,24,25,26)