7-(3-chlorophenyl)-9-methoxy-4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(3-chlorophenyl)-9-methoxy-4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(3-chlorophenyl)-9-methoxy-4-(2-thienylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(3-chlorophenyl)-9-methoxy-4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(3-chlorophenyl)-9-methoxy-4-(thiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(3-chlorophenyl)-9-methoxy-4-(2-thenyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C21H20ClNO2S MolecularWeight: 385.907

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCN(C2)CC3=CC=CS3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC(=CC2=C1OCCN(C2)CC3=CC=CS3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H20ClNO2S/c1-24-20-12-16(15-4-2-5-18(22)11-15)10-17-13-23(7-8-25-21(17)20)14-19-6-3-9-26-19/h2-6,9-12H,7-8,13-14H2,1H3