3-[3-(1-azanylethenylamino)propyl]-4-phenethyl-1-(4-phenylphenyl)carbonyl-azetidin-2-one

Systemtic Name: 3-[3-(1-azanylethenylamino)propyl]-4-phenethyl-1-(4-phenylphenyl)carbonyl-azetidin-2-one Openeye Name: 3-[3-(1-aminovinylamino)propyl]-4-phenethyl-1-(4-phenylbenzoyl)azetidin-2-one CAS Name: 3-[3-(1-aminoethenylamino)propyl]-1-[oxo-(4-phenylphenyl)methyl]-4-phenethyl-2-azetidinone IUPAC Name: 3-[3-(1-aminoethenylamino)propyl]-4-phenethyl-1-(4-phenylbenzoyl)azetidin-2-one Traditional Name: 3-[3-(1-aminovinylamino)propyl]-4-phenethyl-1-(4-phenylbenzoyl)azetidin-2-one Formula: C29H31N3O2 MolecularWeight: 453.57534

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Descriptors Computed from Structure

Canonical SMILES:

C=C(N)NCCCC1C(N(C1=O)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

C=C(N)NCCCC1C(N(C1=O)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O2/c1-21(30)31-20-8-13-26-27(19-14-22-9-4-2-5-10-22)32(29(26)34)28(33)25-17-15-24(16-18-25)23-11-6-3-7-12-23/h2-7,9-12,15-18,26-27,31H,1,8,13-14,19-20,30H2