6-bromanyl-1-(4-ethoxyphenyl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine; ethanedioic acid

Systemtic Name: 6-bromanyl-1-(4-ethoxyphenyl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine; ethanedioic acid Openeye Name: 6-bromo-1-(4-ethoxyphenyl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine; oxalic acid CAS Name: 6-bromo-1-(4-ethoxyphenyl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine; oxalic acid IUPAC Name: 6-bromo-1-(4-ethoxyphenyl)-2,3-dihydropyrrolo[2,3-b]quinolin-4-amine; oxalic acid Traditional Name: (6-bromo-1-p-phenetyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-yl)amine; oxalic acid Formula: C21H20BrN3O5 MolecularWeight: 474.3046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CCC3=C(C4=C(C=CC(=C4)Br)N=C32)N.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2CCC3=C(C4=C(C=CC(=C4)Br)N=C32)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H18BrN3O.C2H2O4/c1-2-24-14-6-4-13(5-7-14)23-10-9-15-18(21)16-11-12(20)3-8-17(16)22-19(15)23;3-1(4)2(5)6/h3-8,11H,2,9-10H2,1H3,(H2,21,22);(H,3,4)(H,5,6)