3-butoxy-4-[(E)-[2-tert-butyl-7-(diethylamino)chromen-4-ylidene]methyl]cyclobutane-1,2-dione

Systemtic Name: 3-butoxy-4-[(E)-[2-tert-butyl-7-(diethylamino)chromen-4-ylidene]methyl]cyclobutane-1,2-dione Openeye Name: 3-butoxy-4-[(E)-[2-tert-butyl-7-(diethylamino)chromen-4-ylidene]methyl]cyclobutane-1,2-dione CAS Name: 3-butoxy-4-[(E)-[2-tert-butyl-7-(diethylamino)-1-benzopyran-4-ylidene]methyl]cyclobutane-1,2-dione IUPAC Name: 3-butoxy-4-[(E)-[2-tert-butyl-7-(diethylamino)chromen-4-ylidene]methyl]cyclobutane-1,2-dione Traditional Name: 3-butoxy-4-[(E)-[2-tert-butyl-7-(diethylamino)chromen-4-ylidene]methyl]cyclobutane-1,2-quinone Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1C(C(=O)C1=O)C=C2C=C(OC3=C2C=CC(=C3)N(CC)CC)C(C)(C)C

Isomeric SMILES

CCCCOC1C(C(=O)C1=O)/C=C/2\C=C(OC3=C2C=CC(=C3)N(CC)CC)C(C)(C)C

InChI

InChI=1S/C26H35NO4/c1-7-10-13-30-25-20(23(28)24(25)29)14-17-15-22(26(4,5)6)31-21-16-18(11-12-19(17)21)27(8-2)9-3/h11-12,14-16,20,25H,7-10,13H2,1-6H3/b17-14+