2-[[(2S)-1-[[(2R)-2-azanyl-3-phenyl-propyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoylamino]ethanoic acid

Systemtic Name: 2-[[(2S)-1-[[(2R)-2-azanyl-3-phenyl-propyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoylamino]ethanoic acid Openeye Name: 2-[[(1S)-1-[[(2R)-2-amino-3-phenyl-propyl]carbamoyl]-3-methyl-butyl]carbamoylamino]acetic acid CAS Name: 2-[[[[(2S)-1-[[(2R)-2-amino-3-phenylpropyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[(2S)-1-[[(2R)-2-amino-3-phenylpropyl]amino]-4-methyl-1-oxopentan-2-yl]carbamoylamino]acetic acid Traditional Name: 2-[[(1S)-1-[[(2R)-2-amino-3-phenyl-propyl]carbamoyl]-3-methyl-butyl]carbamoylamino]acetic acid Formula: C18H28N4O4 MolecularWeight: 364.43932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[C@@H](C(=O)NC[C@@H](CC1=CC=CC=C1)N)NC(=O)NCC(=O)O

InChI

InChI=1S/C18H28N4O4/c1-12(2)8-15(22-18(26)21-11-16(23)24)17(25)20-10-14(19)9-13-6-4-3-5-7-13/h3-7,12,14-15H,8-11,19H2,1-2H3,(H,20,25)(H,23,24)(H2,21,22,26)/t14-,15+/m1/s1