4-(3-morpholin-4-ium-4-ylpropylamino)-3-(phenylmethyl)chromen-2-one

Systemtic Name: 4-(3-morpholin-4-ium-4-ylpropylamino)-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-4-(3-morpholin-4-ium-4-ylpropylamino)chromen-2-one CAS Name: 4-[3-(4-morpholin-4-iumyl)propylamino]-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-4-(3-morpholin-4-ium-4-ylpropylamino)chromen-2-one Traditional Name: 3-benzyl-4-(3-morpholin-4-ium-4-ylpropylamino)coumarin Formula: C23H27N2O3+ MolecularWeight: 379.47208

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=C(C(=O)OC3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCCNC2=C(C(=O)OC3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O3/c26-23-20(17-18-7-2-1-3-8-18)22(19-9-4-5-10-21(19)28-23)24-11-6-12-25-13-15-27-16-14-25/h1-5,7-10,24H,6,11-17H2/p+1