2-cyclohexylidene-3-[(1-methylindol-3-yl)methylidene]butanedioic acid

Systemtic Name: 2-cyclohexylidene-3-[(1-methylindol-3-yl)methylidene]butanedioic acid Openeye Name: 2-cyclohexylidene-3-[(1-methylindol-3-yl)methylene]butanedioic acid CAS Name: 2-cyclohexylidene-3-[(1-methyl-3-indolyl)methylidene]butanedioic acid IUPAC Name: 2-cyclohexylidene-3-[(1-methylindol-3-yl)methylidene]butanedioic acid Traditional Name: 2-cyclohexylidene-3-[(1-methylindol-3-yl)methylene]succinic acid Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C=C(C(=C3CCCCC3)C(=O)O)C(=O)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C=C(C(=C3CCCCC3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H21NO4/c1-21-12-14(15-9-5-6-10-17(15)21)11-16(19(22)23)18(20(24)25)13-7-3-2-4-8-13/h5-6,9-12H,2-4,7-8H2,1H3,(H,22,23)(H,24,25)