2-[1-(3-azanylpropyl)indol-3-yl]-4-ethyl-benzo[g]quinoxalin-3-one; ethanoic acid

Systemtic Name: 2-[1-(3-azanylpropyl)indol-3-yl]-4-ethyl-benzo[g]quinoxalin-3-one; ethanoic acid Openeye Name: acetic acid; 2-[1-(3-aminopropyl)indol-3-yl]-4-ethyl-benzo[g]quinoxalin-3-one CAS Name: acetic acid; 2-[1-(3-aminopropyl)-3-indolyl]-4-ethyl-3-benzo[g]quinoxalinone IUPAC Name: acetic acid; 2-[1-(3-aminopropyl)indol-3-yl]-4-ethylbenzo[g]quinoxalin-3-one Traditional Name: acetic acid; 2-[1-(3-aminopropyl)indol-3-yl]-4-ethyl-benzo[g]quinoxalin-3-one Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC3=CC=CC=C3C=C2N=C(C1=O)C4=CN(C5=CC=CC=C54)CCCN.CC(=O)O

Isomeric SMILES

CCN1C2=CC3=CC=CC=C3C=C2N=C(C1=O)C4=CN(C5=CC=CC=C54)CCCN.CC(=O)O

InChI

InChI=1S/C25H24N4O.C2H4O2/c1-2-29-23-15-18-9-4-3-8-17(18)14-21(23)27-24(25(29)30)20-16-28(13-7-12-26)22-11-6-5-10-19(20)22;1-2(3)4/h3-6,8-11,14-16H,2,7,12-13,26H2,1H3;1H3,(H,3,4)