(2S)-2-acetamido-N-[(3S)-7-azanyl-1-chloranyl-2-oxidanylidene-heptan-3-yl]-3-phenyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-[(3S)-7-azanyl-1-chloranyl-2-oxidanylidene-heptan-3-yl]-3-phenyl-propanamide Openeye Name: (2S)-2-acetamido-N-[(1S)-5-amino-1-(2-chloroacetyl)pentyl]-3-phenyl-propanamide CAS Name: (2S)-2-acetamido-N-[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]-3-phenylpropanamide IUPAC Name: (2S)-2-acetamido-N-[(3S)-7-amino-1-chloro-2-oxoheptan-3-yl]-3-phenylpropanamide Traditional Name: (2S)-2-acetamido-N-[(1S)-5-amino-1-(2-chloroacetyl)pentyl]-3-phenyl-propionamide Formula: C18H26ClN3O3 MolecularWeight: 367.87034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCCCN)C(=O)CCl

Isomeric SMILES

CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCCN)C(=O)CCl

InChI

InChI=1S/C18H26ClN3O3/c1-13(23)21-16(11-14-7-3-2-4-8-14)18(25)22-15(17(24)12-19)9-5-6-10-20/h2-4,7-8,15-16H,5-6,9-12,20H2,1H3,(H,21,23)(H,22,25)/t15-,16-/m0/s1