1-[(3,7-dimethyl-1H-indol-2-yl)methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol

Systemtic Name: 1-[(3,7-dimethyl-1H-indol-2-yl)methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol Openeye Name: 1-[(3,7-dimethyl-1H-indol-2-yl)methyl]-4-[(3-phenylisoxazol-5-yl)methyl]piperidin-1-ium-4-ol CAS Name: 1-[(3,7-dimethyl-1H-indol-2-yl)methyl]-4-[(3-phenyl-5-isoxazolyl)methyl]-4-piperidin-1-iumol IUPAC Name: 1-[(3,7-dimethyl-1H-indol-2-yl)methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol Traditional Name: 1-[(3,7-dimethyl-1H-indol-2-yl)methyl]-4-[(3-phenylisoxazol-5-yl)methyl]piperidin-1-ium-4-ol Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=C2C)C[NH+]3CCC(CC3)(CC4=CC(=NO4)C5=CC=CC=C5)O

Isomeric SMILES

CC1=CC=CC2=C1NC(=C2C)C[NH+]3CCC(CC3)(CC4=CC(=NO4)C5=CC=CC=C5)O

InChI

InChI=1S/C26H29N3O2/c1-18-7-6-10-22-19(2)24(27-25(18)22)17-29-13-11-26(30,12-14-29)16-21-15-23(28-31-21)20-8-4-3-5-9-20/h3-10,15,27,30H,11-14,16-17H2,1-2H3/p+1