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(2-cyanophenyl)methyl 4-(cyclopropylamino)-3-nitro-benzoate

(2-cyanophenyl)methyl 4-(cyclopropylamino)-3-nitro-benzoate

Systemtic Name:(2-cyanophenyl)methyl 4-(cyclopropylamino)-3-nitro-benzoate
Openeye Name:(2-cyanophenyl)methyl 4-(cyclopropylamino)-3-nitro-benzoate
CAS Name:4-(cyclopropylamino)-3-nitrobenzoic acid (2-cyanophenyl)methyl ester
IUPAC Name:(2-cyanophenyl)methyl 4-(cyclopropylamino)-3-nitrobenzoate
Traditional Name:4-(cyclopropylamino)-3-nitro-benzoic acid (2-cyanobenzyl) ester
Formula: C18H15N3O4
MolecularWeight: 337.3294
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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)OCC3=CC=CC=C3C#N)[N+](=O)[O-]


Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)OCC3=CC=CC=C3C#N)[N+](=O)[O-]


InChI

InChI=1S/C18H15N3O4/c19-10-13-3-1-2-4-14(13)11-25-18(22)12-5-8-16(20-15-6-7-15)17(9-12)21(23)24/h1-5,8-9,15,20H,6-7,11H2


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