N-[3-[(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)amino]-3-oxidanylidene-propyl]-3-methyl-benzamide

Systemtic Name: N-[3-[(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)amino]-3-oxidanylidene-propyl]-3-methyl-benzamide Openeye Name: N-[3-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)amino]-3-oxo-propyl]-3-methyl-benzamide CAS Name: N-[3-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)amino]-3-oxopropyl]-3-methylbenzamide IUPAC Name: N-[3-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)amino]-3-oxopropyl]-3-methylbenzamide Traditional Name: N-[3-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)amino]-3-keto-propyl]-3-methyl-benzamide Formula: C20H21ClN2O4 MolecularWeight: 388.84474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCC(=O)NC2=CC3=C(C=C2Cl)OCCCO3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCC(=O)NC2=CC3=C(C=C2Cl)OCCCO3

InChI

InChI=1S/C20H21ClN2O4/c1-13-4-2-5-14(10-13)20(25)22-7-6-19(24)23-16-12-18-17(11-15(16)21)26-8-3-9-27-18/h2,4-5,10-12H,3,6-9H2,1H3,(H,22,25)(H,23,24)