2-bromanyl-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-3-nitro-benzamide

Systemtic Name: 2-bromanyl-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-3-nitro-benzamide Openeye Name: 2-bromo-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-3-nitro-benzamide CAS Name: 2-bromo-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-3-nitrobenzamide IUPAC Name: 2-bromo-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-3-nitrobenzamide Traditional Name: 2-bromo-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-3-nitro-benzamide Formula: C21H19BrN4O5 MolecularWeight: 487.30336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=C2C=C3C(=CC2=NC=C1)OCO3)C(=O)C4=C(C(=CC=C4)[N+](=O)[O-])Br

Isomeric SMILES

CN(C)CCN(C1=C2C=C3C(=CC2=NC=C1)OCO3)C(=O)C4=C(C(=CC=C4)[N+](=O)[O-])Br

InChI

InChI=1S/C21H19BrN4O5/c1-24(2)8-9-25(21(27)13-4-3-5-17(20(13)22)26(28)29)16-6-7-23-15-11-19-18(10-14(15)16)30-12-31-19/h3-7,10-11H,8-9,12H2,1-2H3