2-[(3-methoxyphenyl)methoxy]-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]propan-1-one

Systemtic Name: 2-[(3-methoxyphenyl)methoxy]-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]propan-1-one Openeye Name: 2-[(3-methoxyphenyl)methoxy]-1-[4-(tetrahydrofuran-2-ylmethyl)-1,4-diazepan-1-yl]propan-1-one CAS Name: 2-[(3-methoxyphenyl)methoxy]-1-[4-(2-oxolanylmethyl)-1,4-diazepan-1-yl]-1-propanone IUPAC Name: 2-[(3-methoxyphenyl)methoxy]-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]propan-1-one Traditional Name: 2-m-anisyloxy-1-[4-(tetrahydrofurfuryl)-1,4-diazepan-1-yl]propan-1-one Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCN(CC1)CC2CCCO2)OCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C(=O)N1CCCN(CC1)CC2CCCO2)OCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H32N2O4/c1-17(27-16-18-6-3-7-19(14-18)25-2)21(24)23-10-5-9-22(11-12-23)15-20-8-4-13-26-20/h3,6-7,14,17,20H,4-5,8-13,15-16H2,1-2H3