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N-(1-adamantylmethyl)-4-(cyclopropylamino)-3-nitro-benzamide

N-(1-adamantylmethyl)-4-(cyclopropylamino)-3-nitro-benzamide

Systemtic Name:N-(1-adamantylmethyl)-4-(cyclopropylamino)-3-nitro-benzamide
Openeye Name:N-(1-adamantylmethyl)-4-(cyclopropylamino)-3-nitro-benzamide
CAS Name:N-(1-adamantylmethyl)-4-(cyclopropylamino)-3-nitrobenzamide
IUPAC Name:N-(1-adamantylmethyl)-4-(cyclopropylamino)-3-nitrobenzamide
Traditional Name:N-(1-adamantylmethyl)-4-(cyclopropylamino)-3-nitro-benzamide
Formula: C21H27N3O3
MolecularWeight: 369.45738
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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]


Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)[N+](=O)[O-]


InChI

InChI=1S/C21H27N3O3/c25-20(16-1-4-18(23-17-2-3-17)19(8-16)24(26)27)22-12-21-9-13-5-14(10-21)7-15(6-13)11-21/h1,4,8,13-15,17,23H,2-3,5-7,9-12H2,(H,22,25)


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