(E)-4-[cycloheptyl(pyridin-2-ylmethyl)amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[cycloheptyl(pyridin-2-ylmethyl)amino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[cycloheptyl(2-pyridylmethyl)amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[cycloheptyl(2-pyridinylmethyl)amino]-4-oxo-2-butenoate IUPAC Name: (E)-4-[cycloheptyl(pyridin-2-ylmethyl)amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[cycloheptyl(2-pyridylmethyl)amino]-4-keto-but-2-enoate Formula: C17H21N2O3- MolecularWeight: 301.36024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N(CC2=CC=CC=N2)C(=O)C=CC(=O)[O-]

Isomeric SMILES

C1CCCC(CC1)N(CC2=CC=CC=N2)C(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C17H22N2O3/c20-16(10-11-17(21)22)19(13-14-7-5-6-12-18-14)15-8-3-1-2-4-9-15/h5-7,10-12,15H,1-4,8-9,13H2,(H,21,22)/p-1/b11-10+