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

Systemtic Name: 2-diethylaminoethyl 2-[2-(3-methylphenyl)cyclopropyl]-4-oxidanylidene-3-propyl-chromene-6-carboxylate Openeye Name: 2-diethylaminoethyl 2-[2-(m-tolyl)cyclopropyl]-4-oxo-3-propyl-chromene-6-carboxylate CAS Name: 2-[2-(3-methylphenyl)cyclopropyl]-4-oxo-3-propyl-1-benzopyran-6-carboxylic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 2-[2-(3-methylphenyl)cyclopropyl]-4-oxo-3-propylchromene-6-carboxylate Traditional Name: 4-keto-2-[2-(m-tolyl)cyclopropyl]-3-propyl-chromene-6-carboxylic acid 2-diethylaminoethyl ester Formula: C29H35NO4 MolecularWeight: 461.5925

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)OCCN(CC)CC)C3CC3C4=CC(=CC=C4)C

Isomeric SMILES

CCCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)OCCN(CC)CC)C3CC3C4=CC(=CC=C4)C

InChI

InChI=1S/C29H35NO4/c1-5-9-22-27(31)25-17-21(29(32)33-15-14-30(6-2)7-3)12-13-26(25)34-28(22)24-18-23(24)20-11-8-10-19(4)16-20/h8,10-13,16-17,23-24H,5-7,9,14-15,18H2,1-4H3