(4S)-4-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-5-(dipentylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-5-(dipentylamino)-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-5-(dipentylamino)-5-oxo-pentanoic acid CAS Name: (4S)-4-[[(2S)-2-acetamido-1-oxo-3-phenylpropyl]amino]-5-(dipentylamino)-5-oxopentanoic acid IUPAC Name: (4S)-4-[[(2S)-2-acetamido-3-phenylpropanoyl]amino]-5-(dipentylamino)-5-oxopentanoic acid Traditional Name: (4S)-4-[[(2S)-2-acetamido-3-phenyl-propanoyl]amino]-5-(diamylamino)-5-keto-valeric acid Formula: C26H41N3O5 MolecularWeight: 475.62084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)C

Isomeric SMILES

CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C

InChI

InChI=1S/C26H41N3O5/c1-4-6-11-17-29(18-12-7-5-2)26(34)22(15-16-24(31)32)28-25(33)23(27-20(3)30)19-21-13-9-8-10-14-21/h8-10,13-14,22-23H,4-7,11-12,15-19H2,1-3H3,(H,27,30)(H,28,33)(H,31,32)/t22-,23-/m0/s1