N-[bis(azanyl)methylidene]-3-(2H-chromen-4-yl)benzamide; methanesulfonic acid

Systemtic Name: N-[bis(azanyl)methylidene]-3-(2H-chromen-4-yl)benzamide; methanesulfonic acid Openeye Name: 3-(2H-chromen-4-yl)-N-(diaminomethylene)benzamide; methanesulfonic acid CAS Name: 3-(2H-1-benzopyran-4-yl)-N-(diaminomethylidene)benzamide; methanesulfonic acid IUPAC Name: 3-(2H-chromen-4-yl)-N-(diaminomethylidene)benzamide; methanesulfonic acid Traditional Name: 3-(2H-chromen-4-yl)-N-(diaminomethylene)benzamide; mesylic acid Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1C=C(C2=CC=CC=C2O1)C3=CC(=CC=C3)C(=O)N=C(N)N

Isomeric SMILES

CS(=O)(=O)O.C1C=C(C2=CC=CC=C2O1)C3=CC(=CC=C3)C(=O)N=C(N)N

InChI

InChI=1S/C17H15N3O2.CH4O3S/c18-17(19)20-16(21)12-5-3-4-11(10-12)13-8-9-22-15-7-2-1-6-14(13)15;1-5(2,3)4/h1-8,10H,9H2,(H4,18,19,20,21);1H3,(H,2,3,4)