(2-chloranyl-4-nitro-phenyl)methyl 3-(1H-indol-3-yl)propanoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl)methyl 3-(1H-indol-3-yl)propanoate Openeye Name: (2-chloro-4-nitro-phenyl)methyl 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid (2-chloro-4-nitrophenyl)methyl ester IUPAC Name: (2-chloro-4-nitrophenyl)methyl 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid (2-chloro-4-nitro-benzyl) ester Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCC(=O)OCC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCC(=O)OCC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H15ClN2O4/c19-16-9-14(21(23)24)7-5-13(16)11-25-18(22)8-6-12-10-20-17-4-2-1-3-15(12)17/h1-5,7,9-10,20H,6,8,11H2