[7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-cyclopropyl-methanone

Systemtic Name: [7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-cyclopropyl-methanone Openeye Name: [7-(3-chlorophenyl)-9-(3-thienylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-cyclopropyl-methanone CAS Name: [7-(3-chlorophenyl)-9-(3-thiophenylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-cyclopropylmethanone IUPAC Name: [7-(3-chlorophenyl)-9-(thiophen-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-cyclopropylmethanone Traditional Name: [7-(3-chlorophenyl)-9-(3-thenyloxy)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-cyclopropyl-methanone Formula: C24H22ClNO3S MolecularWeight: 439.95438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCOC3=C(C2)C=C(C=C3OCC4=CSC=C4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CC1C(=O)N2CCOC3=C(C2)C=C(C=C3OCC4=CSC=C4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C24H22ClNO3S/c25-21-3-1-2-18(11-21)19-10-20-13-26(24(27)17-4-5-17)7-8-28-23(20)22(12-19)29-14-16-6-9-30-15-16/h1-3,6,9-12,15,17H,4-5,7-8,13-14H2