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4-[(2-acetamido-6-azanyl-hexanoyl)amino]-2-phenyl-benzoic acid

4-[(2-acetamido-6-azanyl-hexanoyl)amino]-2-phenyl-benzoic acid

Systemtic Name:4-[(2-acetamido-6-azanyl-hexanoyl)amino]-2-phenyl-benzoic acid
Openeye Name:4-[(2-acetamido-6-amino-hexanoyl)amino]-2-phenyl-benzoic acid
CAS Name:4-[(2-acetamido-6-amino-1-oxohexyl)amino]-2-phenylbenzoic acid
IUPAC Name:4-[(2-acetamido-6-aminohexanoyl)amino]-2-phenylbenzoic acid
Traditional Name:4-[(2-acetamido-6-amino-hexanoyl)amino]-2-phenyl-benzoic acid
Formula: C21H25N3O4
MolecularWeight: 383.4409
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCN)C(=O)NC1=CC(=C(C=C1)C(=O)O)C2=CC=CC=C2


Isomeric SMILES

CC(=O)NC(CCCCN)C(=O)NC1=CC(=C(C=C1)C(=O)O)C2=CC=CC=C2


InChI

InChI=1S/C21H25N3O4/c1-14(25)23-19(9-5-6-12-22)20(26)24-16-10-11-17(21(27)28)18(13-16)15-7-3-2-4-8-15/h2-4,7-8,10-11,13,19H,5-6,9,12,22H2,1H3,(H,23,25)(H,24,26)(H,27,28)


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