5-(7-chloranyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazole-3-carboxamide

Systemtic Name: 5-(7-chloranyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazole-3-carboxamide Openeye Name: 1-allyl-5-(7-chloro-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-4,5,6,7-tetrahydroindazole-3-carboxamide CAS Name: 5-(7-chloro-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazole-3-carboxamide IUPAC Name: 5-(7-chloro-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-1-prop-2-enyl-4,5,6,7-tetrahydroindazole-3-carboxamide Traditional Name: 1-allyl-5-(7-chloro-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-4,5,6,7-tetrahydroindazole-3-carboxamide Formula: C22H27ClN4O2 MolecularWeight: 414.92838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=NN(C2=C1CC(CC2)N3CCOC4=C(C3)C=C(C=C4)Cl)CC=C

Isomeric SMILES

CN(C)C(=O)C1=NN(C2=C1CC(CC2)N3CCOC4=C(C3)C=C(C=C4)Cl)CC=C

InChI

InChI=1S/C22H27ClN4O2/c1-4-9-27-19-7-6-17(13-18(19)21(24-27)22(28)25(2)3)26-10-11-29-20-8-5-16(23)12-15(20)14-26/h4-5,8,12,17H,1,6-7,9-11,13-14H2,2-3H3