1-(1-adamantyl)-3-[(3-chloranyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]urea

Systemtic Name: 1-(1-adamantyl)-3-[(3-chloranyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]urea Openeye Name: 1-(1-adamantyl)-3-[(3-chloro-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]urea CAS Name: 1-(1-adamantyl)-3-[(3-chloro-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]urea IUPAC Name: 1-(1-adamantyl)-3-[(3-chloro-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]urea Traditional Name: 1-(1-adamantyl)-3-[(3-chloro-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]urea Formula: C19H24ClN3O3 MolecularWeight: 377.86516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)NC23CC4CC(C2)CC(C4)C3)C=C(C1=O)Cl

Isomeric SMILES

COC1=CC(=CNNC(=O)NC23CC4CC(C2)CC(C4)C3)C=C(C1=O)Cl

InChI

InChI=1S/C19H24ClN3O3/c1-26-16-6-14(5-15(20)17(16)24)10-21-23-18(25)22-19-7-11-2-12(8-19)4-13(3-11)9-19/h5-6,10-13,21H,2-4,7-9H2,1H3,(H2,22,23,25)