methyl (E)-3-[3-aminocarbonyl-4-[(1-propan-2-ylpiperidin-4-yl)carbonylamino]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[3-aminocarbonyl-4-[(1-propan-2-ylpiperidin-4-yl)carbonylamino]phenyl]prop-2-enoate Openeye Name: methyl (E)-3-[3-carbamoyl-4-[(1-isopropylpiperidine-4-carbonyl)amino]phenyl]prop-2-enoate CAS Name: (E)-3-[3-carbamoyl-4-[[oxo-(1-propan-2-yl-4-piperidinyl)methyl]amino]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-carbamoyl-4-[(1-propan-2-ylpiperidine-4-carbonyl)amino]phenyl]prop-2-enoate Traditional Name: (E)-3-[3-carbamoyl-4-[(1-isopropylisonipecotoyl)amino]phenyl]acrylic acid methyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)C=CC(=O)OC)C(=O)N

Isomeric SMILES

CC(C)N1CCC(CC1)C(=O)NC2=C(C=C(C=C2)/C=C/C(=O)OC)C(=O)N

InChI

InChI=1S/C20H27N3O4/c1-13(2)23-10-8-15(9-11-23)20(26)22-17-6-4-14(5-7-18(24)27-3)12-16(17)19(21)25/h4-7,12-13,15H,8-11H2,1-3H3,(H2,21,25)(H,22,26)/b7-5+