N-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(2-methyl-4-oxidanylidene-quinazolin-3-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(2-methyl-4-oxo-quinazolin-3-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-(2-methyl-4-oxo-3-quinazolinyl)-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(2-methyl-4-oxoquinazolin-3-yl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-keto-2-methyl-quinazolin-3-yl)-3-nitro-4-pyrrolidino-benzamide Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4/c1-13-21-16-7-3-2-6-15(16)20(27)24(13)22-19(26)14-8-9-17(18(12-14)25(28)29)23-10-4-5-11-23/h2-3,6-9,12H,4-5,10-11H2,1H3,(H,22,26)