ethyl (Z)-2-isocyano-5-methoxy-5-[(2S)-1-[(4-methoxyphenyl)-diphenyl-methyl]aziridin-2-yl]pent-2-enoate

Systemtic Name: ethyl (Z)-2-isocyano-5-methoxy-5-[(2S)-1-[(4-methoxyphenyl)-diphenyl-methyl]aziridin-2-yl]pent-2-enoate Openeye Name: ethyl (Z)-2-isocyano-5-methoxy-5-[(2S)-1-[(4-methoxyphenyl)-diphenyl-methyl]aziridin-2-yl]pent-2-enoate CAS Name: (Z)-2-isocyano-5-methoxy-5-[(2S)-1-[(4-methoxyphenyl)-diphenylmethyl]-2-aziridinyl]-2-pentenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-isocyano-5-methoxy-5-[(2S)-1-[(4-methoxyphenyl)-diphenylmethyl]aziridin-2-yl]pent-2-enoate Traditional Name: (Z)-2-isocyano-5-methoxy-5-[(2S)-1-[(4-methoxyphenyl)-diphenyl-methyl]ethylenimin-2-yl]pent-2-enoic acid ethyl ester Formula: C31H32N2O4 MolecularWeight: 496.59678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CCC(C1CN1C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)OC)OC)[N+]#[C-]

Isomeric SMILES

CCOC(=O)/C(=C/CC([C@@H]1CN1C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)OC)OC)/[N+]#[C-]

InChI

InChI=1S/C31H32N2O4/c1-5-37-30(34)27(32-2)20-21-29(36-4)28-22-33(28)31(23-12-8-6-9-13-23,24-14-10-7-11-15-24)25-16-18-26(35-3)19-17-25/h6-20,28-29H,5,21-22H2,1,3-4H3/b27-20-/t28-,29?,33?/m0/s1