2-[4-(6H-benzo[c][1,5]benzothiazepin-11-yl)piperidin-1-yl]propanoic acid

Systemtic Name: 2-[4-(6H-benzo[c][1,5]benzothiazepin-11-yl)piperidin-1-yl]propanoic acid Openeye Name: 2-[4-(6H-benzo[c][1,5]benzothiazepin-11-yl)-1-piperidyl]propanoic acid CAS Name: 2-[4-(6H-benzo[c][1,5]benzothiazepin-11-yl)-1-piperidinyl]propanoic acid IUPAC Name: 2-[4-(6H-benzo[c][1,5]benzothiazepin-11-yl)piperidin-1-yl]propanoic acid Traditional Name: 2-[4-(6H-benzo[c][1,5]benzothiazepin-11-yl)piperidino]propionic acid Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1CCC(CC1)N2C3=CC=CC=C3CSC4=CC=CC=C42

Isomeric SMILES

CC(C(=O)O)N1CCC(CC1)N2C3=CC=CC=C3CSC4=CC=CC=C42

InChI

InChI=1S/C21H24N2O2S/c1-15(21(24)25)22-12-10-17(11-13-22)23-18-7-3-2-6-16(18)14-26-20-9-5-4-8-19(20)23/h2-9,15,17H,10-14H2,1H3,(H,24,25)