4-chloranyl-11-[(2-hydroxyethylamino)methyl]-6H-benzo[c][1]benzothiepin-11-ol

Systemtic Name: 4-chloranyl-11-[(2-hydroxyethylamino)methyl]-6H-benzo[c][1]benzothiepin-11-ol Openeye Name: 4-chloro-11-[(2-hydroxyethylamino)methyl]-6H-benzo[c][1]benzothiepin-11-ol CAS Name: 4-chloro-11-[(2-hydroxyethylamino)methyl]-6H-benzo[c][1]benzothiepin-11-ol IUPAC Name: 4-chloro-11-[(2-hydroxyethylamino)methyl]-6H-benzo[c][1]benzothiepin-11-ol Traditional Name: 4-chloro-11-[(2-hydroxyethylamino)methyl]-6H-benzo[c][1]benzothiepin-11-ol Formula: C17H18ClNO2S MolecularWeight: 335.84832

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(C3=C(S1)C(=CC=C3)Cl)(CNCCO)O

Isomeric SMILES

C1C2=CC=CC=C2C(C3=C(S1)C(=CC=C3)Cl)(CNCCO)O

InChI

InChI=1S/C17H18ClNO2S/c18-15-7-3-6-14-16(15)22-10-12-4-1-2-5-13(12)17(14,21)11-19-8-9-20/h1-7,19-21H,8-11H2