2-(1-butylindol-3-yl)butanedioic acid

Systemtic Name: 2-(1-butylindol-3-yl)butanedioic acid Openeye Name: 2-(1-butylindol-3-yl)butanedioic acid CAS Name: 2-(1-butyl-3-indolyl)butanedioic acid IUPAC Name: 2-(1-butylindol-3-yl)butanedioic acid Traditional Name: 2-(1-butylindol-3-yl)succinic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C2=CC=CC=C21)C(CC(=O)O)C(=O)O

Isomeric SMILES

CCCCN1C=C(C2=CC=CC=C21)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C16H19NO4/c1-2-3-8-17-10-13(11-6-4-5-7-14(11)17)12(16(20)21)9-15(18)19/h4-7,10,12H,2-3,8-9H2,1H3,(H,18,19)(H,20,21)