[2-[(4-methoxyphenyl)methylamino]-4-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl] butanoate

Systemtic Name: [2-[(4-methoxyphenyl)methylamino]-4-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl] butanoate Openeye Name: [4-[1-hydroxy-2-(isopropylamino)ethyl]-2-[(4-methoxyphenyl)methylamino]phenyl] butanoate CAS Name: butanoic acid [4-[1-hydroxy-2-(propan-2-ylamino)ethyl]-2-[(4-methoxyphenyl)methylamino]phenyl] ester IUPAC Name: [4-[1-hydroxy-2-(propan-2-ylamino)ethyl]-2-[(4-methoxyphenyl)methylamino]phenyl] butanoate Traditional Name: butyric acid [4-[1-hydroxy-2-(isopropylamino)ethyl]-2-(p-anisylamino)phenyl] ester Formula: C23H32N2O4 MolecularWeight: 400.51118

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C(C=C1)C(CNC(C)C)O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCCC(=O)OC1=C(C=C(C=C1)C(CNC(C)C)O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C23H32N2O4/c1-5-6-23(27)29-22-12-9-18(21(26)15-24-16(2)3)13-20(22)25-14-17-7-10-19(28-4)11-8-17/h7-13,16,21,24-26H,5-6,14-15H2,1-4H3