butyl 3-(methylamino)-3-oxidanylidene-2-[4-(1-pyridin-4-ylpiperidin-4-yl)phenoxy]propanoate

Systemtic Name: butyl 3-(methylamino)-3-oxidanylidene-2-[4-(1-pyridin-4-ylpiperidin-4-yl)phenoxy]propanoate Openeye Name: butyl 3-(methylamino)-3-oxo-2-[4-[1-(4-pyridyl)-4-piperidyl]phenoxy]propanoate CAS Name: 3-(methylamino)-3-oxo-2-[4-(1-pyridin-4-yl-4-piperidinyl)phenoxy]propanoic acid butyl ester IUPAC Name: butyl 3-(methylamino)-3-oxo-2-[4-(1-pyridin-4-ylpiperidin-4-yl)phenoxy]propanoate Traditional Name: 3-keto-3-(methylamino)-2-[4-[1-(4-pyridyl)-4-piperidyl]phenoxy]propionic acid butyl ester Formula: C24H31N3O4 MolecularWeight: 425.52064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C(=O)NC)OC1=CC=C(C=C1)C2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CCCCOC(=O)C(C(=O)NC)OC1=CC=C(C=C1)C2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C24H31N3O4/c1-3-4-17-30-24(29)22(23(28)25-2)31-21-7-5-18(6-8-21)19-11-15-27(16-12-19)20-9-13-26-14-10-20/h5-10,13-14,19,22H,3-4,11-12,15-17H2,1-2H3,(H,25,28)