8-[1-(3-azanylpropyl)-2-ethyl-indol-3-yl]-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinoxalin-7-one; ethanoic acid

Systemtic Name: 8-[1-(3-azanylpropyl)-2-ethyl-indol-3-yl]-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinoxalin-7-one; ethanoic acid Openeye Name: acetic acid; 8-[1-(3-aminopropyl)-2-ethyl-indol-3-yl]-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinoxalin-7-one CAS Name: acetic acid; 8-[1-(3-aminopropyl)-2-ethyl-3-indolyl]-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinoxalin-7-one IUPAC Name: acetic acid; 8-[1-(3-aminopropyl)-2-ethylindol-3-yl]-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinoxalin-7-one Traditional Name: acetic acid; 8-[1-(3-aminopropyl)-2-ethyl-indol-3-yl]-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinoxalin-7-one Formula: C25H28N4O5 MolecularWeight: 464.51362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2N1CCCN)C3=NC4=CC5=C(C=C4NC3=O)OCCO5.CC(=O)O

Isomeric SMILES

CCC1=C(C2=CC=CC=C2N1CCCN)C3=NC4=CC5=C(C=C4NC3=O)OCCO5.CC(=O)O

InChI

InChI=1S/C23H24N4O3.C2H4O2/c1-2-17-21(14-6-3-4-7-18(14)27(17)9-5-8-24)22-23(28)26-16-13-20-19(12-15(16)25-22)29-10-11-30-20;1-2(3)4/h3-4,6-7,12-13H,2,5,8-11,24H2,1H3,(H,26,28);1H3,(H,3,4)