(Z)-2-(1,3-benzothiazol-2-yl)-3-(3-nitro-4-piperidin-1-yl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-(3-nitro-4-piperidin-1-yl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-[3-nitro-4-(1-piperidyl)phenyl]-1-phenyl-prop-2-en-1-one CAS Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-[3-nitro-4-(1-piperidinyl)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-(3-nitro-4-piperidin-1-ylphenyl)-1-phenylprop-2-en-1-one Traditional Name: (Z)-2-(1,3-benzothiazol-2-yl)-3-(3-nitro-4-piperidino-phenyl)-1-phenyl-prop-2-en-1-one Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C=C(C3=NC4=CC=CC=C4S3)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)/C=C(\C3=NC4=CC=CC=C4S3)/C(=O)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H23N3O3S/c31-26(20-9-3-1-4-10-20)21(27-28-22-11-5-6-12-25(22)34-27)17-19-13-14-23(24(18-19)30(32)33)29-15-7-2-8-16-29/h1,3-6,9-14,17-18H,2,7-8,15-16H2/b21-17-