3-methylbutyl (2S)-2-[(1-azanylcyclopentyl)carbonylamino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: 3-methylbutyl (2S)-2-[(1-azanylcyclopentyl)carbonylamino]-3-(4-hydroxyphenyl)propanoate Openeye Name: isopentyl (2S)-2-[(1-aminocyclopentanecarbonyl)amino]-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-2-[[(1-aminocyclopentyl)-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl (2S)-2-[(1-aminocyclopentanecarbonyl)amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-[(1-aminocyclopentanecarbonyl)amino]-3-(4-hydroxyphenyl)propionic acid isoamyl ester Formula: C20H30N2O4 MolecularWeight: 362.4632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2(CCCC2)N

Isomeric SMILES

CC(C)CCOC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C2(CCCC2)N

InChI

InChI=1S/C20H30N2O4/c1-14(2)9-12-26-18(24)17(13-15-5-7-16(23)8-6-15)22-19(25)20(21)10-3-4-11-20/h5-8,14,17,23H,3-4,9-13,21H2,1-2H3,(H,22,25)/t17-/m0/s1