7-[1-(3-azanylpropyl)-2-(4-chlorophenyl)indol-3-yl]-5H-[1,3]dioxolo[4,5-g]quinoxalin-6-one; ethanoic acid

Systemtic Name: 7-[1-(3-azanylpropyl)-2-(4-chlorophenyl)indol-3-yl]-5H-[1,3]dioxolo[4,5-g]quinoxalin-6-one; ethanoic acid Openeye Name: acetic acid; 7-[1-(3-aminopropyl)-2-(4-chlorophenyl)indol-3-yl]-5H-[1,3]dioxolo[4,5-g]quinoxalin-6-one CAS Name: acetic acid; 7-[1-(3-aminopropyl)-2-(4-chlorophenyl)-3-indolyl]-5H-[1,3]dioxolo[4,5-g]quinoxalin-6-one IUPAC Name: acetic acid; 7-[1-(3-aminopropyl)-2-(4-chlorophenyl)indol-3-yl]-5H-[1,3]dioxolo[4,5-g]quinoxalin-6-one Traditional Name: acetic acid; 7-[1-(3-aminopropyl)-2-(4-chlorophenyl)indol-3-yl]-5H-[1,3]dioxolo[4,5-g]quinoxalin-6-one Formula: C28H25ClN4O5 MolecularWeight: 532.9749

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1OC2=C(O1)C=C3C(=C2)NC(=O)C(=N3)C4=C(N(C5=CC=CC=C54)CCCN)C6=CC=C(C=C6)Cl

Isomeric SMILES

CC(=O)O.C1OC2=C(O1)C=C3C(=C2)NC(=O)C(=N3)C4=C(N(C5=CC=CC=C54)CCCN)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C26H21ClN4O3.C2H4O2/c27-16-8-6-15(7-9-16)25-23(17-4-1-2-5-20(17)31(25)11-3-10-28)24-26(32)30-19-13-22-21(33-14-34-22)12-18(19)29-24;1-2(3)4/h1-2,4-9,12-13H,3,10-11,14,28H2,(H,30,32);1H3,(H,3,4)