4-chloranyl-N-[(2S,3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-methyl-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: 4-chloranyl-N-[(2S,3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-methyl-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1S,2S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-methyl-butyl]benzamide CAS Name: 4-chloro-N-[(2S,3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-methyl-1-oxopentan-2-yl]benzamide IUPAC Name: 4-chloro-N-[(2S,3S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-methyl-1-oxopentan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S,2S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-methyl-butyl]benzamide Formula: C22H25ClN2O4 MolecularWeight: 416.8979

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NC1=CC2=C(C=C1)OCCCO2)NC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O4/c1-3-14(2)20(25-21(26)15-5-7-16(23)8-6-15)22(27)24-17-9-10-18-19(13-17)29-12-4-11-28-18/h5-10,13-14,20H,3-4,11-12H2,1-2H3,(H,24,27)(H,25,26)/t14-,20-/m0/s1