8-(azepan-1-ylmethyl)-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 8-(azepan-1-ylmethyl)-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 8-(azepan-1-ylmethyl)-7-hydroxy-4-methyl-chromen-2-one CAS Name: 8-(1-azepanylmethyl)-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 8-(azepan-1-ylmethyl)-7-hydroxy-4-methylchromen-2-one Traditional Name: 8-(azepan-1-ylmethyl)-7-hydroxy-4-methyl-coumarin Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2CN3CCCCCC3)O

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2CN3CCCCCC3)O

InChI

InChI=1S/C17H21NO3/c1-12-10-16(20)21-17-13(12)6-7-15(19)14(17)11-18-8-4-2-3-5-9-18/h6-7,10,19H,2-5,8-9,11H2,1H3