N-[2,6-di(propan-2-yl)phenyl]-4-(ethylamino)-3-nitro-benzamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-4-(ethylamino)-3-nitro-benzamide Openeye Name: N-(2,6-diisopropylphenyl)-4-(ethylamino)-3-nitro-benzamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-4-(ethylamino)-3-nitrobenzamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-4-(ethylamino)-3-nitrobenzamide Traditional Name: N-(2,6-diisopropylphenyl)-4-(ethylamino)-3-nitro-benzamide Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H27N3O3/c1-6-22-18-11-10-15(12-19(18)24(26)27)21(25)23-20-16(13(2)3)8-7-9-17(20)14(4)5/h7-14,22H,6H2,1-5H3,(H,23,25)