4-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enyl]-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-2-one

Systemtic Name: 4-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enyl]-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-[(E)-3-(4-hydroxy-3-methoxy-phenyl)allyl]-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one CAS Name: 4-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl]-1-(4-oxanylmethyl)-6-phenylmethoxy-1,4-diazepan-2-one IUPAC Name: 4-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl]-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-[(E)-3-(4-hydroxy-3-methoxy-phenyl)allyl]-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-2-one Formula: C28H36N2O5 MolecularWeight: 480.59584

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CCN2CC(CN(C(=O)C2)CC3CCOCC3)OCC4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/CN2CC(CN(C(=O)C2)CC3CCOCC3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C28H36N2O5/c1-33-27-16-22(9-10-26(27)31)8-5-13-29-18-25(35-21-24-6-3-2-4-7-24)19-30(28(32)20-29)17-23-11-14-34-15-12-23/h2-10,16,23,25,31H,11-15,17-21H2,1H3/b8-5+