6-azanyl-2-[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]ethanoylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]ethanoylamino]hexanoic acid Openeye Name: 6-amino-2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]acetyl]amino]hexanoic acid CAS Name: 6-amino-2-[[2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-1-oxo-3-phenylpropyl]amino]-1-oxoethyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[2-[[2-[(2-amino-4-methylpentanoyl)amino]-3-phenylpropanoyl]amino]acetyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-phenyl-propanoyl]amino]acetyl]amino]hexanoic acid Formula: C23H37N5O5 MolecularWeight: 463.57038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NCC(=O)NC(CCCCN)C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NCC(=O)NC(CCCCN)C(=O)O)N

InChI

InChI=1S/C23H37N5O5/c1-15(2)12-17(25)21(30)28-19(13-16-8-4-3-5-9-16)22(31)26-14-20(29)27-18(23(32)33)10-6-7-11-24/h3-5,8-9,15,17-19H,6-7,10-14,24-25H2,1-2H3,(H,26,31)(H,27,29)(H,28,30)(H,32,33)