1-[(3-methylpyridin-2-yl)-(3,4,5-trimethoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3-methylpyridin-2-yl)-(3,4,5-trimethoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3-methyl-2-pyridyl)-(3,4,5-trimethoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(3-methyl-2-pyridinyl)-(3,4,5-trimethoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-methylpyridin-2-yl)-(3,4,5-trimethoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3-methyl-2-pyridyl)-(3,4,5-trimethoxyphenyl)methyl]-1,4-diazepane Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=CC(=C(C(=C2)OC)OC)OC)N3CCCNCC3

Isomeric SMILES

CC1=C(N=CC=C1)C(C2=CC(=C(C(=C2)OC)OC)OC)N3CCCNCC3

InChI

InChI=1S/C21H29N3O3/c1-15-7-5-9-23-19(15)20(24-11-6-8-22-10-12-24)16-13-17(25-2)21(27-4)18(14-16)26-3/h5,7,9,13-14,20,22H,6,8,10-12H2,1-4H3