(Z)-but-2-enedioic acid; 3-(1,4-diazepan-1-yl)-1-(4-methylphenyl)quinoxalin-2-one

Systemtic Name: (Z)-but-2-enedioic acid; 3-(1,4-diazepan-1-yl)-1-(4-methylphenyl)quinoxalin-2-one Openeye Name: 3-(1,4-diazepan-1-yl)-1-(p-tolyl)quinoxalin-2-one; maleic acid CAS Name: (Z)-2-butenedioic acid; 3-(1,4-diazepan-1-yl)-1-(4-methylphenyl)-2-quinoxalinone IUPAC Name: (Z)-but-2-enedioic acid; 3-(1,4-diazepan-1-yl)-1-(4-methylphenyl)quinoxalin-2-one Traditional Name: 3-(1,4-diazepan-1-yl)-1-(p-tolyl)quinoxalin-2-one; maleic acid Formula: C24H26N4O5 MolecularWeight: 450.48704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C(C2=O)N4CCCNCC4.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C(C2=O)N4CCCNCC4.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C20H22N4O.C4H4O4/c1-15-7-9-16(10-8-15)24-18-6-3-2-5-17(18)22-19(20(24)25)23-13-4-11-21-12-14-23;5-3(6)1-2-4(7)8/h2-3,5-10,21H,4,11-14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-