7-(5-methylthiophen-2-yl)-9-(oxan-2-ylmethoxy)-4-propyl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(5-methylthiophen-2-yl)-9-(oxan-2-ylmethoxy)-4-propyl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(5-methyl-2-thienyl)-4-propyl-9-(tetrahydropyran-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(5-methyl-2-thiophenyl)-9-(2-oxanylmethoxy)-4-propyl-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(5-methylthiophen-2-yl)-9-(oxan-2-ylmethoxy)-4-propyl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(5-methyl-2-thienyl)-4-propyl-9-(tetrahydropyran-2-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C23H31NO3S MolecularWeight: 401.56214

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCOC2=C(C1)C=C(C=C2OCC3CCCCO3)C4=CC=C(S4)C

Isomeric SMILES

CCCN1CCOC2=C(C1)C=C(C=C2OCC3CCCCO3)C4=CC=C(S4)C

InChI

InChI=1S/C23H31NO3S/c1-3-9-24-10-12-26-23-19(15-24)13-18(22-8-7-17(2)28-22)14-21(23)27-16-20-6-4-5-11-25-20/h7-8,13-14,20H,3-6,9-12,15-16H2,1-2H3