1'-prop-2-ynylspiro[benzo[b][1]benzothiepine-5,4'-piperidine]-6-one

Systemtic Name: 1'-prop-2-ynylspiro[benzo[b][1]benzothiepine-5,4'-piperidine]-6-one Openeye Name: 1'-prop-2-ynylspiro[benzo[b][1]benzothiepine-5,4'-piperidine]-6-one CAS Name: 1'-prop-2-ynyl-6-spiro[benzo[b][1]benzothiepin-5,4'-piperidine]one IUPAC Name: 1'-prop-2-ynylspiro[benzo[b][1]benzothiepine-5,4'-piperidine]-6-one Traditional Name: 1'-propargylspiro[benzo[b][1]benzothiepin-5,4'-piperidine]-6-one Formula: C21H19NOS MolecularWeight: 333.44666

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCC2(CC1)C3=CC=CC=C3SC4=CC=CC=C4C2=O

Isomeric SMILES

C#CCN1CCC2(CC1)C3=CC=CC=C3SC4=CC=CC=C4C2=O

InChI

InChI=1S/C21H19NOS/c1-2-13-22-14-11-21(12-15-22)17-8-4-6-10-19(17)24-18-9-5-3-7-16(18)20(21)23/h1,3-10H,11-15H2