4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]butyl 3-phenylprop-2-enoate

Systemtic Name: 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]butyl 3-phenylprop-2-enoate Openeye Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butyl 3-phenylprop-2-enoate CAS Name: 3-phenyl-2-propenoic acid 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butyl ester IUPAC Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butyl 3-phenylprop-2-enoate Traditional Name: 3-phenylacrylic acid 4-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]butyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)OCCCCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)C=CC(=O)OCCCCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H20N2O4S/c23-19(13-12-16-8-2-1-3-9-16)26-15-7-6-14-21-20-17-10-4-5-11-18(17)27(24,25)22-20/h1-5,8-13H,6-7,14-15H2,(H,21,22)