7-chloranyl-2-(4-methoxyphenyl)-2,4-dimethyl-1,3-dihydro-1,3,4-benzotriazepin-5-one

Systemtic Name: 7-chloranyl-2-(4-methoxyphenyl)-2,4-dimethyl-1,3-dihydro-1,3,4-benzotriazepin-5-one Openeye Name: 7-chloro-2-(4-methoxyphenyl)-2,4-dimethyl-1,3-dihydro-1,3,4-benzotriazepin-5-one CAS Name: 7-chloro-2-(4-methoxyphenyl)-2,4-dimethyl-1,3-dihydro-1,3,4-benzotriazepin-5-one IUPAC Name: 7-chloro-2-(4-methoxyphenyl)-2,4-dimethyl-1,3-dihydro-1,3,4-benzotriazepin-5-one Traditional Name: 7-chloro-2-(4-methoxyphenyl)-2,4-dimethyl-1,3-dihydro-1,3,4-benzotriazepin-5-one Formula: C17H18ClN3O2 MolecularWeight: 331.79672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(NC2=C(C=C(C=C2)Cl)C(=O)N(N1)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1(NC2=C(C=C(C=C2)Cl)C(=O)N(N1)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H18ClN3O2/c1-17(11-4-7-13(23-3)8-5-11)19-15-9-6-12(18)10-14(15)16(22)21(2)20-17/h4-10,19-20H,1-3H3