3-[(E)-[4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ylidene]methyl]phenol

Systemtic Name: 3-[(E)-[4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ylidene]methyl]phenol Openeye Name: 3-[(E)-[4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ylidene]methyl]phenol CAS Name: 3-[(E)-[4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ylidene]methyl]phenol IUPAC Name: 3-[(E)-[4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ylidene]methyl]phenol Traditional Name: 3-[(E)-[4-(dimethylaminomethyl)-3,4-dihydro-2H-1-benzothiepin-5-ylidene]methyl]phenol Formula: C20H23NOS MolecularWeight: 325.46772

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCSC2=CC=CC=C2C1=CC3=CC(=CC=C3)O

Isomeric SMILES

CN(C)CC\1CCSC2=CC=CC=C2/C1=C/C3=CC(=CC=C3)O

InChI

InChI=1S/C20H23NOS/c1-21(2)14-16-10-11-23-20-9-4-3-8-18(20)19(16)13-15-6-5-7-17(22)12-15/h3-9,12-13,16,22H,10-11,14H2,1-2H3/b19-13+