3-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-oxidanylidene-propyl]-7-methoxy-4-methyl-chromen-2-one

Systemtic Name: 3-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-oxidanylidene-propyl]-7-methoxy-4-methyl-chromen-2-one Openeye Name: 3-[3-[4-(azepane-1-carbonyl)-1-piperidyl]-3-oxo-propyl]-7-methoxy-4-methyl-chromen-2-one CAS Name: 3-[3-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-3-oxopropyl]-7-methoxy-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[3-[4-(azepane-1-carbonyl)piperidin-1-yl]-3-oxopropyl]-7-methoxy-4-methylchromen-2-one Traditional Name: 3-[3-[4-(azepane-1-carbonyl)piperidino]-3-keto-propyl]-7-methoxy-4-methyl-coumarin Formula: C26H34N2O5 MolecularWeight: 454.55856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C26H34N2O5/c1-18-21-8-7-20(32-2)17-23(21)33-26(31)22(18)9-10-24(29)27-15-11-19(12-16-27)25(30)28-13-5-3-4-6-14-28/h7-8,17,19H,3-6,9-16H2,1-2H3