3-tert-butyl-7-(1,3-dimethylazepan-4-yl)oxy-chromen-4-one

Systemtic Name: 3-tert-butyl-7-(1,3-dimethylazepan-4-yl)oxy-chromen-4-one Openeye Name: 3-tert-butyl-7-(1,3-dimethylazepan-4-yl)oxy-chromen-4-one CAS Name: 3-tert-butyl-7-[(1,3-dimethyl-4-azepanyl)oxy]-1-benzopyran-4-one IUPAC Name: 3-tert-butyl-7-(1,3-dimethylazepan-4-yl)oxychromen-4-one Traditional Name: 3-tert-butyl-7-(1,3-dimethylazepan-4-yl)oxy-chromone Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCCC1OC2=CC3=C(C=C2)C(=O)C(=CO3)C(C)(C)C)C

Isomeric SMILES

CC1CN(CCCC1OC2=CC3=C(C=C2)C(=O)C(=CO3)C(C)(C)C)C

InChI

InChI=1S/C21H29NO3/c1-14-12-22(5)10-6-7-18(14)25-15-8-9-16-19(11-15)24-13-17(20(16)23)21(2,3)4/h8-9,11,13-14,18H,6-7,10,12H2,1-5H3