N-[(2S)-1-[2-(2-azanylethoxy)ethylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-(2-naphthalen-1-ylethylamino)butanamide

Systemtic Name: N-[(2S)-1-[2-(2-azanylethoxy)ethylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-(2-naphthalen-1-ylethylamino)butanamide Openeye Name: N-[(1S)-2-[2-(2-aminoethoxy)ethylamino]-1-benzyl-2-oxo-ethyl]-4-[2-(1-naphthyl)ethylamino]butanamide CAS Name: N-[(2S)-1-[2-(2-aminoethoxy)ethylamino]-1-oxo-3-phenylpropan-2-yl]-4-[2-(1-naphthalenyl)ethylamino]butanamide IUPAC Name: N-[(2S)-1-[2-(2-aminoethoxy)ethylamino]-1-oxo-3-phenylpropan-2-yl]-4-(2-naphthalen-1-ylethylamino)butanamide Traditional Name: N-[(1S)-2-[2-(2-aminoethoxy)ethylamino]-1-benzyl-2-keto-ethyl]-4-[2-(1-naphthyl)ethylamino]butyramide Formula: C29H38N4O3 MolecularWeight: 490.63702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCOCCN)NC(=O)CCCNCCC2=CC=CC3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCCOCCN)NC(=O)CCCNCCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C29H38N4O3/c30-16-20-36-21-19-32-29(35)27(22-23-8-2-1-3-9-23)33-28(34)14-7-17-31-18-15-25-12-6-11-24-10-4-5-13-26(24)25/h1-6,8-13,27,31H,7,14-22,30H2,(H,32,35)(H,33,34)/t27-/m0/s1