2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-(3,4-diacetyloxyphenyl)propanoic acid

Systemtic Name: 2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-(3,4-diacetyloxyphenyl)propanoic acid Openeye Name: 2-[(2-amino-4-methyl-pentanoyl)amino]-3-(3,4-diacetoxyphenyl)propanoic acid CAS Name: 2-[(2-amino-4-methyl-1-oxopentyl)amino]-3-(3,4-diacetyloxyphenyl)propanoic acid IUPAC Name: 2-[(2-amino-4-methylpentanoyl)amino]-3-(3,4-diacetyloxyphenyl)propanoic acid Traditional Name: 2-[(2-amino-4-methyl-pentanoyl)amino]-3-(3,4-diacetoxyphenyl)propionic acid Formula: C19H26N2O7 MolecularWeight: 394.41894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC(=C(C=C1)OC(=O)C)OC(=O)C)C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC(=C(C=C1)OC(=O)C)OC(=O)C)C(=O)O)N

InChI

InChI=1S/C19H26N2O7/c1-10(2)7-14(20)18(24)21-15(19(25)26)8-13-5-6-16(27-11(3)22)17(9-13)28-12(4)23/h5-6,9-10,14-15H,7-8,20H2,1-4H3,(H,21,24)(H,25,26)