ethyl (Z)-3-[[(2S)-4-methyl-2-(3-phenylmethoxypropyl)pentyl]amino]but-2-enoate

Systemtic Name: ethyl (Z)-3-[[(2S)-4-methyl-2-(3-phenylmethoxypropyl)pentyl]amino]but-2-enoate Openeye Name: ethyl (Z)-3-[[(2S)-2-(3-benzyloxypropyl)-4-methyl-pentyl]amino]but-2-enoate CAS Name: (Z)-3-[[(2S)-4-methyl-2-(3-phenylmethoxypropyl)pentyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-[[(2S)-4-methyl-2-(3-phenylmethoxypropyl)pentyl]amino]but-2-enoate Traditional Name: (Z)-3-[[(2S)-2-(3-benzoxypropyl)-4-methyl-pentyl]amino]but-2-enoic acid ethyl ester Formula: C22H35NO3 MolecularWeight: 361.5182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NCC(CCCOCC1=CC=CC=C1)CC(C)C

Isomeric SMILES

CCOC(=O)/C=C(/C)\NC[C@@H](CCCOCC1=CC=CC=C1)CC(C)C

InChI

InChI=1S/C22H35NO3/c1-5-26-22(24)15-19(4)23-16-21(14-18(2)3)12-9-13-25-17-20-10-7-6-8-11-20/h6-8,10-11,15,18,21,23H,5,9,12-14,16-17H2,1-4H3/b19-15-/t21-/m0/s1