[2-oxidanylidene-2-(propylamino)ethyl] 2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoate Openeye Name: [2-oxo-2-(propylamino)ethyl] 2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoate CAS Name: 2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-propenoic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] 2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enoate Traditional Name: 2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)acrylic acid [2-keto-2-(propylamino)ethyl] ester Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C(=CC1=C(N(C(=C1)C)CCC)C)C#N

Isomeric SMILES

CCCNC(=O)COC(=O)C(=CC1=C(N(C(=C1)C)CCC)C)C#N

InChI

InChI=1S/C18H25N3O3/c1-5-7-20-17(22)12-24-18(23)16(11-19)10-15-9-13(3)21(8-6-2)14(15)4/h9-10H,5-8,12H2,1-4H3,(H,20,22)