2-[(3,4-dichlorophenyl)amino]-6-nitro-8-[2-(phenoxymethyl)pyrrolidin-1-yl]carbonyl-1H-quinazolin-4-one

Systemtic Name: 2-[(3,4-dichlorophenyl)amino]-6-nitro-8-[2-(phenoxymethyl)pyrrolidin-1-yl]carbonyl-1H-quinazolin-4-one Openeye Name: 2-(3,4-dichloroanilino)-6-nitro-8-[2-(phenoxymethyl)pyrrolidine-1-carbonyl]-1H-quinazolin-4-one CAS Name: 2-(3,4-dichloroanilino)-6-nitro-8-[oxo-[2-(phenoxymethyl)-1-pyrrolidinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-(3,4-dichloroanilino)-6-nitro-8-[2-(phenoxymethyl)pyrrolidine-1-carbonyl]-1H-quinazolin-4-one Traditional Name: 2-(3,4-dichloroanilino)-6-nitro-8-[2-(phenoxymethyl)pyrrolidine-1-carbonyl]-1H-quinazolin-4-one Formula: C26H21Cl2N5O5 MolecularWeight: 554.38144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl)COC5=CC=CC=C5

Isomeric SMILES

C1CC(N(C1)C(=O)C2=C3C(=CC(=C2)[N+](=O)[O-])C(=O)N=C(N3)NC4=CC(=C(C=C4)Cl)Cl)COC5=CC=CC=C5

InChI

InChI=1S/C26H21Cl2N5O5/c27-21-9-8-15(11-22(21)28)29-26-30-23-19(24(34)31-26)12-17(33(36)37)13-20(23)25(35)32-10-4-5-16(32)14-38-18-6-2-1-3-7-18/h1-3,6-9,11-13,16H,4-5,10,14H2,(H2,29,30,31,34)