7-(5-chloranyl-2-methoxy-phenyl)-9-methoxy-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(5-chloranyl-2-methoxy-phenyl)-9-methoxy-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(5-chloro-2-methoxy-phenyl)-9-methoxy-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(5-chloro-2-methoxyphenyl)-9-methoxy-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(5-chloro-2-methoxyphenyl)-9-methoxy-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(5-chloro-2-methoxy-phenyl)-9-methoxy-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C22H23ClN2O3 MolecularWeight: 398.88262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC=CN4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC=CN4

InChI

InChI=1S/C22H23ClN2O3/c1-26-20-6-5-17(23)12-19(20)15-10-16-13-25(14-18-4-3-7-24-18)8-9-28-22(16)21(11-15)27-2/h3-7,10-12,24H,8-9,13-14H2,1-2H3