N-(3-morpholin-4-ium-4-ylpropyl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(3-phenylpropyl)-1,3-benzoxazole-5-carboxamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)OC(=N3)CCCC4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)OC(=N3)CCCC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3/c28-24(25-12-5-13-27-14-16-29-17-15-27)20-10-11-22-21(18-20)26-23(30-22)9-4-8-19-6-2-1-3-7-19/h1-3,6-7,10-11,18H,4-5,8-9,12-17H2,(H,25,28)/p+1