(Z)-but-2-enedioic acid; N-butyl-1-methyl-N-pyridin-4-yl-indol-5-amine

Systemtic Name: (Z)-but-2-enedioic acid; N-butyl-1-methyl-N-pyridin-4-yl-indol-5-amine Openeye Name: N-butyl-1-methyl-N-(4-pyridyl)indol-5-amine; maleic acid CAS Name: (Z)-2-butenedioic acid; N-butyl-1-methyl-N-pyridin-4-yl-5-indolamine IUPAC Name: (Z)-but-2-enedioic acid; N-butyl-1-methyl-N-pyridin-4-ylindol-5-amine Traditional Name: butyl-(1-methylindol-5-yl)-(4-pyridyl)amine; maleic acid Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=NC=C1)C2=CC3=C(C=C2)N(C=C3)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCCN(C1=CC=NC=C1)C2=CC3=C(C=C2)N(C=C3)C.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C18H21N3.C4H4O4/c1-3-4-12-21(16-7-10-19-11-8-16)17-5-6-18-15(14-17)9-13-20(18)2;5-3(6)1-2-4(7)8/h5-11,13-14H,3-4,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-