N-[(Z)-2,3-dihydro-1,4-benzodioxin-5-ylmethylideneamino]-4-(morpholin-4-ium-4-ylmethyl)benzamide

Systemtic Name: N-[(Z)-2,3-dihydro-1,4-benzodioxin-5-ylmethylideneamino]-4-(morpholin-4-ium-4-ylmethyl)benzamide Openeye Name: N-[(Z)-2,3-dihydro-1,4-benzodioxin-5-ylmethyleneamino]-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: N-[(Z)-2,3-dihydro-1,4-benzodioxin-5-ylmethylideneamino]-4-(4-morpholin-4-iumylmethyl)benzamide IUPAC Name: N-[(Z)-2,3-dihydro-1,4-benzodioxin-5-ylmethylideneamino]-4-(morpholin-4-ium-4-ylmethyl)benzamide Traditional Name: N-[(Z)-2,3-dihydro-1,4-benzodioxin-5-ylmethyleneamino]-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C21H24N3O4+ MolecularWeight: 382.43296

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)C(=O)NN=CC3=C4C(=CC=C3)OCCO4

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)C(=O)N/N=C\C3=C4C(=CC=C3)OCCO4

InChI

InChI=1S/C21H23N3O4/c25-21(17-6-4-16(5-7-17)15-24-8-10-26-11-9-24)23-22-14-18-2-1-3-19-20(18)28-13-12-27-19/h1-7,14H,8-13,15H2,(H,23,25)/p+1/b22-14-