ethyl 4-[[(E)-but-2-enoyl]-pyrrolidin-3-yl-amino]benzoate

Systemtic Name: ethyl 4-[[(E)-but-2-enoyl]-pyrrolidin-3-yl-amino]benzoate Openeye Name: ethyl 4-[[(E)-but-2-enoyl]-pyrrolidin-3-yl-amino]benzoate CAS Name: 4-[[(E)-1-oxobut-2-enyl]-(3-pyrrolidinyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-but-2-enoyl]-pyrrolidin-3-ylamino]benzoate Traditional Name: 4-[[(E)-but-2-enoyl]-pyrrolidin-3-yl-amino]benzoic acid ethyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(C2CCNC2)C(=O)C=CC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(C2CCNC2)C(=O)/C=C/C

InChI

InChI=1S/C17H22N2O3/c1-3-5-16(20)19(15-10-11-18-12-15)14-8-6-13(7-9-14)17(21)22-4-2/h3,5-9,15,18H,4,10-12H2,1-2H3/b5-3+