2-azanyl-3-(2,6-dimethyl-4-phenylmethoxy-phenyl)-N-[(2R)-1-oxidanylidene-1-(3-phenylpropylamino)propan-2-yl]propanamide

Systemtic Name: 2-azanyl-3-(2,6-dimethyl-4-phenylmethoxy-phenyl)-N-[(2R)-1-oxidanylidene-1-(3-phenylpropylamino)propan-2-yl]propanamide Openeye Name: 2-amino-3-(4-benzyloxy-2,6-dimethyl-phenyl)-N-[(1R)-1-methyl-2-oxo-2-(3-phenylpropylamino)ethyl]propanamide CAS Name: 2-amino-3-(2,6-dimethyl-4-phenylmethoxyphenyl)-N-[(2R)-1-oxo-1-(3-phenylpropylamino)propan-2-yl]propanamide IUPAC Name: 2-amino-3-(2,6-dimethyl-4-phenylmethoxyphenyl)-N-[(2R)-1-oxo-1-(3-phenylpropylamino)propan-2-yl]propanamide Traditional Name: 2-amino-3-(4-benzoxy-2,6-dimethyl-phenyl)-N-[(1R)-2-keto-1-methyl-2-(3-phenylpropylamino)ethyl]propionamide Formula: C30H37N3O3 MolecularWeight: 487.63308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC(C(=O)NC(C)C(=O)NCCCC2=CC=CC=C2)N)C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1CC(C(=O)N[C@H](C)C(=O)NCCCC2=CC=CC=C2)N)C)OCC3=CC=CC=C3

InChI

InChI=1S/C30H37N3O3/c1-21-17-26(36-20-25-13-8-5-9-14-25)18-22(2)27(21)19-28(31)30(35)33-23(3)29(34)32-16-10-15-24-11-6-4-7-12-24/h4-9,11-14,17-18,23,28H,10,15-16,19-20,31H2,1-3H3,(H,32,34)(H,33,35)/t23-,28?/m1/s1