4-[[(2R)-2-[[4-(azepan-1-yl)phenyl]amino]propanoyl]amino]benzamide

Systemtic Name: 4-[[(2R)-2-[[4-(azepan-1-yl)phenyl]amino]propanoyl]amino]benzamide Openeye Name: 4-[[(2R)-2-[4-(azepan-1-yl)anilino]propanoyl]amino]benzamide CAS Name: 4-[[(2R)-2-[4-(1-azepanyl)anilino]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[[(2R)-2-[4-(azepan-1-yl)anilino]propanoyl]amino]benzamide Traditional Name: 4-[[(2R)-2-[4-(azepan-1-yl)anilino]propanoyl]amino]benzamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C(=O)N)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C22H28N4O2/c1-16(22(28)25-19-8-6-17(7-9-19)21(23)27)24-18-10-12-20(13-11-18)26-14-4-2-3-5-15-26/h6-13,16,24H,2-5,14-15H2,1H3,(H2,23,27)(H,25,28)/t16-/m1/s1