3-[3-(azocan-1-yl)-3-oxidanylidene-propyl]-4,7-dimethyl-chromen-2-one

Systemtic Name: 3-[3-(azocan-1-yl)-3-oxidanylidene-propyl]-4,7-dimethyl-chromen-2-one Openeye Name: 3-[3-(azocan-1-yl)-3-oxo-propyl]-4,7-dimethyl-chromen-2-one CAS Name: 3-[3-(1-azocanyl)-3-oxopropyl]-4,7-dimethyl-1-benzopyran-2-one IUPAC Name: 3-[3-(azocan-1-yl)-3-oxopropyl]-4,7-dimethylchromen-2-one Traditional Name: 3-[3-(azocan-1-yl)-3-keto-propyl]-4,7-dimethyl-coumarin Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)N3CCCCCCC3)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(C(=O)O2)CCC(=O)N3CCCCCCC3)C

InChI

InChI=1S/C21H27NO3/c1-15-8-9-17-16(2)18(21(24)25-19(17)14-15)10-11-20(23)22-12-6-4-3-5-7-13-22/h8-9,14H,3-7,10-13H2,1-2H3