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2-[carboxy-[2-(2-methylpropyl)hex-5-enoyl]amino]-3-phenyl-propanoic acid

2-[carboxy-[2-(2-methylpropyl)hex-5-enoyl]amino]-3-phenyl-propanoic acid

Systemtic Name:2-[carboxy-[2-(2-methylpropyl)hex-5-enoyl]amino]-3-phenyl-propanoic acid
Openeye Name:2-[carboxy(2-isobutylhex-5-enoyl)amino]-3-phenyl-propanoic acid
CAS Name:2-[carboxy-[2-(2-methylpropyl)-1-oxohex-5-enyl]amino]-3-phenylpropanoic acid
IUPAC Name:2-[carboxy-[2-(2-methylpropyl)hex-5-enoyl]amino]-3-phenylpropanoic acid
Traditional Name:2-[carboxy(2-isobutylhex-5-enoyl)amino]-3-phenyl-propionic acid
Formula: C20H27NO5
MolecularWeight: 361.43208
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CCC=C)C(=O)N(C(CC1=CC=CC=C1)C(=O)O)C(=O)O


Isomeric SMILES

CC(C)CC(CCC=C)C(=O)N(C(CC1=CC=CC=C1)C(=O)O)C(=O)O


InChI

InChI=1S/C20H27NO5/c1-4-5-11-16(12-14(2)3)18(22)21(20(25)26)17(19(23)24)13-15-9-7-6-8-10-15/h4,6-10,14,16-17H,1,5,11-13H2,2-3H3,(H,23,24)(H,25,26)


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