butan-1-amine; N-(4-ethoxypyridin-3-yl)-4-oxidanylidene-1,5,6,7-tetrahydroindole-3-carboxamide

Systemtic Name: butan-1-amine; N-(4-ethoxypyridin-3-yl)-4-oxidanylidene-1,5,6,7-tetrahydroindole-3-carboxamide Openeye Name: butan-1-amine; N-(4-ethoxy-3-pyridyl)-4-oxo-1,5,6,7-tetrahydroindole-3-carboxamide CAS Name: 1-butanamine; N-(4-ethoxy-3-pyridinyl)-4-oxo-1,5,6,7-tetrahydroindole-3-carboxamide IUPAC Name: butan-1-amine; N-(4-ethoxypyridin-3-yl)-4-oxo-1,5,6,7-tetrahydroindole-3-carboxamide Traditional Name: butylamine; N-(4-ethoxy-3-pyridyl)-4-keto-1,5,6,7-tetrahydroindole-3-carboxamide Formula: C20H28N4O3 MolecularWeight: 372.46132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN.CCOC1=C(C=NC=C1)NC(=O)C2=CNC3=C2C(=O)CCC3

Isomeric SMILES

CCCCN.CCOC1=C(C=NC=C1)NC(=O)C2=CNC3=C2C(=O)CCC3

InChI

InChI=1S/C16H17N3O3.C4H11N/c1-2-22-14-6-7-17-9-12(14)19-16(21)10-8-18-11-4-3-5-13(20)15(10)11;1-2-3-4-5/h6-9,18H,2-5H2,1H3,(H,19,21);2-5H2,1H3