(phenylmethyl) N-[7-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]heptyl]carbamate

Systemtic Name: (phenylmethyl) N-[7-[[(2S)-2-azanyl-4-methyl-pentanoyl]amino]heptyl]carbamate Openeye Name: benzyl N-[7-[[(2S)-2-amino-4-methyl-pentanoyl]amino]heptyl]carbamate CAS Name: N-[7-[[(2S)-2-amino-4-methyl-1-oxopentyl]amino]heptyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[7-[[(2S)-2-amino-4-methylpentanoyl]amino]heptyl]carbamate Traditional Name: N-[7-[[(2S)-2-amino-4-methyl-pentanoyl]amino]heptyl]carbamic acid benzyl ester Formula: C21H35N3O3 MolecularWeight: 377.5209

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCCCCCCCNC(=O)OCC1=CC=CC=C1)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)NCCCCCCCNC(=O)OCC1=CC=CC=C1)N

InChI

InChI=1S/C21H35N3O3/c1-17(2)15-19(22)20(25)23-13-9-4-3-5-10-14-24-21(26)27-16-18-11-7-6-8-12-18/h6-8,11-12,17,19H,3-5,9-10,13-16,22H2,1-2H3,(H,23,25)(H,24,26)/t19-/m0/s1