[2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl] (E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoate

Systemtic Name: [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl] (E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoate Openeye Name: [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxo-ethyl] (E)-3-(6-methoxy-2-naphthyl)prop-2-enoate CAS Name: (E)-3-(6-methoxy-2-naphthalenyl)-2-propenoic acid [2-[[(1S)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl] (E)-3-(6-methoxynaphthalen-2-yl)prop-2-enoate Traditional Name: (E)-3-(6-methoxy-2-naphthyl)acrylic acid [2-[[(1S)-1-cyano-1-cyclopropyl-ethyl]amino]-2-keto-ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)COC(=O)C=CC2=CC3=C(C=C2)C=C(C=C3)OC

Isomeric SMILES

C[C@@](C#N)(C1CC1)NC(=O)COC(=O)/C=C/C2=CC3=C(C=C2)C=C(C=C3)OC

InChI

InChI=1S/C22H22N2O4/c1-22(14-23,18-7-8-18)24-20(25)13-28-21(26)10-4-15-3-5-17-12-19(27-2)9-6-16(17)11-15/h3-6,9-12,18H,7-8,13H2,1-2H3,(H,24,25)/b10-4+/t22-/m1/s1