2-diethylaminoethyl 3-ethyl-2-[2-(2-methylphenyl)cyclopropyl]-4-oxidanylidene-chromene-6-carboxylate

Systemtic Name: 2-diethylaminoethyl 3-ethyl-2-[2-(2-methylphenyl)cyclopropyl]-4-oxidanylidene-chromene-6-carboxylate Openeye Name: 2-diethylaminoethyl 3-ethyl-2-[2-(o-tolyl)cyclopropyl]-4-oxo-chromene-6-carboxylate CAS Name: 3-ethyl-2-[2-(2-methylphenyl)cyclopropyl]-4-oxo-1-benzopyran-6-carboxylic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 3-ethyl-2-[2-(2-methylphenyl)cyclopropyl]-4-oxochromene-6-carboxylate Traditional Name: 3-ethyl-4-keto-2-[2-(o-tolyl)cyclopropyl]chromene-6-carboxylic acid 2-diethylaminoethyl ester Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)OCCN(CC)CC)C3CC3C4=CC=CC=C4C

Isomeric SMILES

CCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)OCCN(CC)CC)C3CC3C4=CC=CC=C4C

InChI

InChI=1S/C28H33NO4/c1-5-20-26(30)24-16-19(28(31)32-15-14-29(6-2)7-3)12-13-25(24)33-27(20)23-17-22(23)21-11-9-8-10-18(21)4/h8-13,16,22-23H,5-7,14-15,17H2,1-4H3