(E)-2-cyano-N-(3-methoxypropyl)-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[5-(3-nitrophenyl)-2-thienyl]prop-2-enamide CAS Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[5-(3-nitrophenyl)-2-thiophenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[5-(3-nitrophenyl)thiophen-2-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-methoxypropyl)-3-[5-(3-nitrophenyl)-2-thienyl]acrylamide Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C(=CC1=CC=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])C#N

Isomeric SMILES

COCCCNC(=O)/C(=C/C1=CC=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H17N3O4S/c1-25-9-3-8-20-18(22)14(12-19)11-16-6-7-17(26-16)13-4-2-5-15(10-13)21(23)24/h2,4-7,10-11H,3,8-9H2,1H3,(H,20,22)/b14-11+