5-chloranyl-N-[9-(hydroxymethyl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-7-yl]-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-N-[9-(hydroxymethyl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-7-yl]-1H-indole-2-carboxamide Openeye Name: 5-chloro-N-[9-(hydroxymethyl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-7-yl]-1H-indole-2-carboxamide CAS Name: 5-chloro-N-[9-(hydroxymethyl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-7-yl]-1H-indole-2-carboxamide IUPAC Name: 5-chloro-N-[9-(hydroxymethyl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-7-yl]-1H-indole-2-carboxamide Traditional Name: 5-chloro-N-(9-methylol-2,3,4,5-tetrahydro-1,5-benzoxazepin-7-yl)-1H-indole-2-carboxamide Formula: C19H18ClN3O3 MolecularWeight: 371.81752

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=C(C(=CC(=C2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Cl)CO)OC1

Isomeric SMILES

C1CNC2=C(C(=CC(=C2)NC(=O)C3=CC4=C(N3)C=CC(=C4)Cl)CO)OC1

InChI

InChI=1S/C19H18ClN3O3/c20-13-2-3-15-11(6-13)8-17(23-15)19(25)22-14-7-12(10-24)18-16(9-14)21-4-1-5-26-18/h2-3,6-9,21,23-24H,1,4-5,10H2,(H,22,25)