1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-3-(3-methoxyphenyl)propan-1-one

Systemtic Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-3-(3-methoxyphenyl)propan-1-one Openeye Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-3-(3-methoxyphenyl)propan-1-one CAS Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-3-(3-methoxyphenyl)-1-propanone IUPAC Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-3-(3-methoxyphenyl)propan-1-one Traditional Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-3-(3-methoxyphenyl)propan-1-one Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCC(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=CC(=C1)CCC(=O)N2CCCC2C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H25NO4/c1-25-18-5-2-4-16(14-18)7-10-22(24)23-11-3-6-19(23)17-8-9-20-21(15-17)27-13-12-26-20/h2,4-5,8-9,14-15,19H,3,6-7,10-13H2,1H3