(E)-4-(1,3-benzothiazol-2-yl)-5-(6-methoxynaphthalen-2-yl)pent-4-enoic acid

Systemtic Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(6-methoxynaphthalen-2-yl)pent-4-enoic acid Openeye Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(6-methoxy-2-naphthyl)pent-4-enoic acid CAS Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(6-methoxy-2-naphthalenyl)-4-pentenoic acid IUPAC Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(6-methoxynaphthalen-2-yl)pent-4-enoic acid Traditional Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(6-methoxy-2-naphthyl)pent-4-enoic acid Formula: C23H19NO3S MolecularWeight: 389.46686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)C=C(CCC(=O)O)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)/C=C(\CCC(=O)O)/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H19NO3S/c1-27-19-10-8-16-12-15(6-7-17(16)14-19)13-18(9-11-22(25)26)23-24-20-4-2-3-5-21(20)28-23/h2-8,10,12-14H,9,11H2,1H3,(H,25,26)/b18-13+