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

Systemtic Name: 2-bromanyl-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-5-nitro-benzamide Openeye Name: 2-bromo-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-5-nitro-benzamide CAS Name: 2-bromo-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-5-nitrobenzamide IUPAC Name: 2-bromo-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-5-nitrobenzamide Traditional Name: 2-bromo-N-(2-dimethylaminoethyl)-N-([1,3]dioxolo[4,5-g]quinolin-8-yl)-5-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)7-8-25(21(27)14-9-13(26(28)29)3-4-16(14)22)18-5-6-23-17-11-20-19(10-15(17)18)30-12-31-20/h3-6,9-11H,7-8,12H2,1-2H3