2-[5-(3-azanylpropyl)-[1,3]dioxolo[4,5-f]indol-7-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one; ethanoic acid

Systemtic Name: 2-[5-(3-azanylpropyl)-[1,3]dioxolo[4,5-f]indol-7-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one; ethanoic acid Openeye Name: acetic acid; 2-[5-(3-aminopropyl)-[1,3]dioxolo[4,5-f]indol-7-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one CAS Name: acetic acid; 2-[5-(3-aminopropyl)-[1,3]dioxolo[4,5-f]indol-7-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one IUPAC Name: acetic acid; 2-[5-(3-aminopropyl)-[1,3]dioxolo[4,5-f]indol-7-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one Traditional Name: acetic acid; 2-[5-(3-aminopropyl)-[1,3]dioxol[4,5-f]indol-7-yl]-4,6,7,8-tetrahydrocyclopenta[g]quinoxalin-3-one Formula: C25H26N4O5 MolecularWeight: 462.49774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CC2=CC3=C(C=C2C1)N=C(C(=O)N3)C4=CN(C5=CC6=C(C=C54)OCO6)CCCN

Isomeric SMILES

CC(=O)O.C1CC2=CC3=C(C=C2C1)N=C(C(=O)N3)C4=CN(C5=CC6=C(C=C54)OCO6)CCCN

InChI

InChI=1S/C23H22N4O3.C2H4O2/c24-5-2-6-27-11-16(15-9-20-21(10-19(15)27)30-12-29-20)22-23(28)26-18-8-14-4-1-3-13(14)7-17(18)25-22;1-2(3)4/h7-11H,1-6,12,24H2,(H,26,28);1H3,(H,3,4)